Monday, October 31, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 5-(2,3-dihydroxypropoxy)-6-(16-methylheptadecoxy)hexane-1,2,3,4-tetrol
CAS Name: 5-(2,3-dihydroxypropoxy)-6-(16-methylheptadecoxy)hexane-1,2,3,4-tetrol
IUPAC NAME: 5-(2,3-dihydroxypropoxy)-6-(16-methylheptadecoxy)hexane-1,2,3,4-tetrol
SYSTEMATIC NAME: 5-[2,3-bis(oxidanyl)propoxy]-6-(16-methylheptadecoxy)hexane-1,2,3,4-tetrol
MOLECULAR FORMULA: C27H56O8
MOLECULAR WEIGHT: 508.72874
SMILES: CC(C)CCCCCCCCCCCCCCCOCC(C(C(C(CO)O)O)O)OCC(CO)O
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Product OPENEYE NAME: 5-(16-methylheptadecoxy)-6-(oxiran-2-ylmethoxy)hexane-1,2,3,4-tetrol
CAS Name: 5-(16-methylheptadecoxy)-6-(2-oxiranylmethoxy)hexane-1,2,3,4-tetrol
IUPAC NAME: 5-(16-methylheptadecoxy)-6-(oxiran-2-ylmethoxy)hexane-1,2,3,4-tetrol
SYSTEMATIC NAME: 5-(16-methylheptadecoxy)-6-(oxiran-2-ylmethoxy)hexane-1,2,3,4-tetrol
MOLECULAR FORMULA: C27H54O7
MOLECULAR WEIGHT: 490.71346
SMILES: CC(C)CCCCCCCCCCCCCCCOC(COCC1CO1)C(C(C(CO)O)O)O
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Product OPENEYE NAME: [6-methoxy-3-(1-methylhexoxy)-5-(oxiran-2-ylmethoxy)-4-undecoxy-tetrahydropyran-2-yl]methanol
CAS Name: [3-heptan-2-yloxy-6-methoxy-5-(2-oxiranylmethoxy)-4-undecoxy-2-oxanyl]methanol
IUPAC NAME: [3-heptan-2-yloxy-6-methoxy-5-(oxiran-2-ylmethoxy)-4-undecoxyoxan-2-yl]methanol
SYSTEMATIC NAME: [3-heptan-2-yloxy-6-methoxy-5-(oxiran-2-ylmethoxy)-4-undecoxy-oxan-2-yl]methanol
MOLECULAR FORMULA: C28H54O7
MOLECULAR WEIGHT: 502.72416
SMILES: CCCCCCCCCCCOC1C(C(OC(C1OCC2CO2)OC)CO)OC(C)CCCCC
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Product OPENEYE NAME: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-(octadecoxymethyl)oxirane
CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-(octadecoxymethyl)oxirane
IUPAC NAME: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-(octadecoxymethyl)oxirane
SYSTEMATIC NAME: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-(octadecoxymethyl)oxirane
MOLECULAR FORMULA: C26H54O6
MOLECULAR WEIGHT: 462.70336
SMILES: CCCCCCCCCCCCCCCCCCOCC1CO1.C(C(CO)(CO)CO)O
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Product OPENEYE NAME: 4-(acetylsulfamoyl)benzenesulfonyl chloride
CAS Name: 4-(acetylsulfamoyl)benzenesulfonyl chloride
IUPAC NAME: 4-(acetylsulfamoyl)benzenesulfonyl chloride
SYSTEMATIC NAME: 4-(ethanoylsulfamoyl)benzenesulfonyl chloride
MOLECULAR FORMULA: C8H8ClNO5S2
MOLECULAR WEIGHT: 297.73582
SMILES: CC(=O)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)Cl
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Product OPENEYE NAME: 4-[1-(6-methylpyrazolo[5,1-c][1,2,4]triazol-1-yl)tridecoxy]aniline
CAS Name: 4-[1-(6-methyl-1-pyrazolo[5,1-c][1,2,4]triazolyl)tridecoxy]aniline
IUPAC NAME: 4-[1-(6-methylpyrazolo[5,1-c][1,2,4]triazol-1-yl)tridecoxy]aniline
SYSTEMATIC NAME: 4-[1-(6-methylpyrazolo[5,1-c][1,2,4]triazol-1-yl)tridecoxy]aniline
MOLECULAR FORMULA: C24H37N5O
MOLECULAR WEIGHT: 411.58348
SMILES: CCCCCCCCCCCCC(N1C2=CC(=NN2C=N1)C)OC3=CC=C(C=C3)N
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Product OPENEYE NAME: tert-butyl 4-benzyl-2,2-dimethyl-5-(2-methyl-2-vinyl-cyclohexyl)oxazolidine-3-carboxylate
CAS Name: 5-(2-ethenyl-2-methylcyclohexyl)-2,2-dimethyl-4-(phenylmethyl)-3-oxazolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-benzyl-5-(2-ethenyl-2-methylcyclohexyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
SYSTEMATIC NAME: tert-butyl 5-(2-ethenyl-2-methyl-cyclohexyl)-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylate
MOLECULAR FORMULA: C26H39NO3
MOLECULAR WEIGHT: 413.59276
SMILES: CC1(N(C(C(O1)C2CCCCC2(C)C=C)CC3=CC=CC=C3)C(=O)OC(C)(C)C)C
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Product OPENEYE NAME: N-[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenyl-butyl]-2-[(3,5-dichlorobenzoyl)amino]butanediamide
CAS Name: N-[4-[tert-butyl-[cyclohexyl(oxo)methyl]amino]-1-hydroxy-1-phenylbutyl]-2-[[(3,5-dichlorophenyl)-oxomethyl]amino]butanediamide
IUPAC NAME: N-[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenylbutyl]-2-[(3,5-dichlorobenzoyl)amino]butanediamide
SYSTEMATIC NAME: 2-[[3,5-bis(chloranyl)phenyl]carbonylamino]-N-[4-[tert-butyl(cyclohexylcarbonyl)amino]-1-oxidanyl-1-phenyl-butyl]butanediamide
MOLECULAR FORMULA: C32H42Cl2N4O5
MOLECULAR WEIGHT: 633.60568
SMILES: CC(C)(C)N(CCCC(C1=CC=CC=C1)(NC(=O)C(CC(=O)N)NC(=O)C2=CC(=CC(=C2)Cl)Cl)O)C(=O)C3CCCCC3
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Product OPENEYE NAME: methyl 3-(benzyloxycarbonylamino)-4-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenyl-butyl]amino]-4-oxo-butanoate
CAS Name: 4-[[4-[tert-butyl-[cyclohexyl(oxo)methyl]amino]-1-hydroxy-1-phenylbutyl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid methyl ester
IUPAC NAME: methyl 4-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenylbutyl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoate
SYSTEMATIC NAME: methyl 4-[[4-[tert-butyl(cyclohexylcarbonyl)amino]-1-oxidanyl-1-phenyl-butyl]amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate
MOLECULAR FORMULA: C34H47N3O7
MOLECULAR WEIGHT: 609.75288
SMILES: CC(C)(C)N(CCCC(C1=CC=CC=C1)(NC(=O)C(CC(=O)OC)NC(=O)OCC2=CC=CC=C2)O)C(=O)C3CCCCC3
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Product OPENEYE NAME: N-(3-amino-4-oxo-butanoyl)quinoline-2-carboxamide
CAS Name: N-(3-amino-1,4-dioxobutyl)-2-quinolinecarboxamide
IUPAC NAME: N-(3-amino-4-oxobutanoyl)quinoline-2-carboxamide
SYSTEMATIC NAME: N-(3-azanyl-4-oxidanylidene-butanoyl)quinoline-2-carboxamide
MOLECULAR FORMULA: C14H13N3O3
MOLECULAR WEIGHT: 271.27132
SMILES: C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC(=O)CC(C=O)N
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Product OPENEYE NAME: 1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexanecarbaldehyde
CAS Name: 1-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-cyclohexanecarboxaldehyde
IUPAC NAME: 1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexane-1-carbaldehyde
SYSTEMATIC NAME: 1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexane-1-carbaldehyde
MOLECULAR FORMULA: C14H28O2Si
MOLECULAR WEIGHT: 256.45642
SMILES: CC(C)(C)[Si](C)(C)OCC1(CCCCC1)C=O
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Product OPENEYE NAME: N-tert-butyl-N-(2-hydroxy-4-phenyl-butyl)cyclohexanecarboxamide
CAS Name: N-tert-butyl-N-(2-hydroxy-4-phenylbutyl)cyclohexanecarboxamide
IUPAC NAME: N-tert-butyl-N-(2-hydroxy-4-phenylbutyl)cyclohexanecarboxamide
SYSTEMATIC NAME: N-tert-butyl-N-(2-oxidanyl-4-phenyl-butyl)cyclohexanecarboxamide
MOLECULAR FORMULA: C21H33NO2
MOLECULAR WEIGHT: 331.49222
SMILES: CC(C)(C)N(CC(CCC1=CC=CC=C1)O)C(=O)C2CCCCC2
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Product OPENEYE NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methanol
CAS Name: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methanol
IUPAC NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methanol
SYSTEMATIC NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methanol
MOLECULAR FORMULA: C14H30O2Si
MOLECULAR WEIGHT: 258.4723
SMILES: CC(C)(C)[Si](C)(C)OCC1(CCCCC1)CO
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Product OPENEYE NAME: tert-butyl 4-benzyl-5-[tert-butyl-(1-methylcyclohexanecarbonyl)amino]-2,2-dimethyl-oxazolidine-3-carboxylate
CAS Name: 5-[tert-butyl-[(1-methylcyclohexyl)-oxomethyl]amino]-2,2-dimethyl-4-(phenylmethyl)-3-oxazolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-benzyl-5-[tert-butyl-(1-methylcyclohexanecarbonyl)amino]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
SYSTEMATIC NAME: tert-butyl 5-[tert-butyl-(1-methylcyclohexyl)carbonyl-amino]-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylate
MOLECULAR FORMULA: C29H46N2O4
MOLECULAR WEIGHT: 486.68654
SMILES: CC1(N(C(C(O1)N(C(=O)C2(CCCCC2)C)C(C)(C)C)CC3=CC=CC=C3)C(=O)OC(C)(C)C)C
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Product OPENEYE NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-3-en-1-yl]methanol
CAS Name: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-cyclohex-3-enyl]methanol
IUPAC NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-3-en-1-yl]methanol
SYSTEMATIC NAME: [1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-3-en-1-yl]methanol
MOLECULAR FORMULA: C14H28O2Si
MOLECULAR WEIGHT: 256.45642
SMILES: CC(C)(C)[Si](C)(C)OCC1(CCC=CC1)CO
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Product OPENEYE NAME: benzyl N-[1-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-3-oxo-1-phenyl-butyl]carbamoyl]-2-methyl-propyl]carbamate
CAS Name: N-[1-[[4-[tert-butyl-[cyclohexyl(oxo)methyl]amino]-3-oxo-1-phenylbutyl]amino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[1-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-3-oxo-1-phenylbutyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-[[4-[tert-butyl(cyclohexylcarbonyl)amino]-3-oxidanylidene-1-phenyl-butyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate
MOLECULAR FORMULA: C34H47N3O5
MOLECULAR WEIGHT: 577.75408
SMILES: CC(C)C(C(=O)NC(CC(=O)CN(C(=O)C1CCCCC1)C(C)(C)C)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: 2-amino-N-[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenyl-butyl]butanediamide
CAS Name: 2-amino-N-[4-[tert-butyl-[cyclohexyl(oxo)methyl]amino]-1-hydroxy-1-phenylbutyl]butanediamide
IUPAC NAME: 2-amino-N-[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenylbutyl]butanediamide
SYSTEMATIC NAME: 2-azanyl-N-[4-[tert-butyl(cyclohexylcarbonyl)amino]-1-oxidanyl-1-phenyl-butyl]butanediamide
MOLECULAR FORMULA: C25H40N4O4
MOLECULAR WEIGHT: 460.6095
SMILES: CC(C)(C)N(CCCC(C1=CC=CC=C1)(NC(=O)C(CC(=O)N)N)O)C(=O)C2CCCCC2
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Product OPENEYE NAME: benzyl N-[1-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenyl-butyl]carbamoyl]-2,2-dimethyl-propyl]carbamate
CAS Name: N-[1-[[4-[tert-butyl-[cyclohexyl(oxo)methyl]amino]-1-hydroxy-1-phenylbutyl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[1-[[4-[tert-butyl(cyclohexanecarbonyl)amino]-1-hydroxy-1-phenylbutyl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-[[4-[tert-butyl(cyclohexylcarbonyl)amino]-1-oxidanyl-1-phenyl-butyl]amino]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate
MOLECULAR FORMULA: C35H51N3O5
MOLECULAR WEIGHT: 593.79654
SMILES: CC(C)(C)C(C(=O)NC(CCCN(C(=O)C1CCCCC1)C(C)(C)C)(C2=CC=CC=C2)O)NC(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: 2-(4-benzyl-3-tert-butoxycarbonyl-2,2-dimethyl-oxazolidin-5-yl)-1-methyl-cyclohexanecarboxylic acid
CAS Name: 2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(phenylmethyl)-5-oxazolidinyl]-1-methyl-1-cyclohexanecarboxylic acid
IUPAC NAME: 2-[4-benzyl-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-oxazolidin-5-yl]-1-methylcyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-4-(phenylmethyl)-1,3-oxazolidin-5-yl]-1-methyl-cyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C25H37NO5
MOLECULAR WEIGHT: 431.56498
SMILES: CC1(N(C(C(O1)C2CCCCC2(C)C(=O)O)CC3=CC=CC=C3)C(=O)OC(C)(C)C)C
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Product OPENEYE NAME: methyl 2-(tert-butoxycarbonylamino)-1-(4-hydroxy-4-phenyl-butyl)cyclohexanecarboxylate
CAS Name: 1-(4-hydroxy-4-phenylbutyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester
IUPAC NAME: methyl 1-(4-hydroxy-4-phenylbutyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate
SYSTEMATIC NAME: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(4-oxidanyl-4-phenyl-butyl)cyclohexane-1-carboxylate
MOLECULAR FORMULA: C23H35NO5
MOLECULAR WEIGHT: 405.5277
SMILES: CC(C)(C)OC(=O)NC1CCCCC1(CCCC(C2=CC=CC=C2)O)C(=O)OC
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Product OPENEYE NAME: benzyl N-[2-[2-tert-butyl-2-(3-butyl-2-cyano-7-hydroxy-7-phenyl-heptanoyl)hydrazino]-1-(cyanomethyl)-2-oxo-ethyl]carbamate
CAS Name: N-[1-[2-tert-butyl-2-(3-butyl-2-cyano-7-hydroxy-1-oxo-7-phenylheptyl)hydrazinyl]-3-cyano-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[1-[2-tert-butyl-2-(3-butyl-2-cyano-7-hydroxy-7-phenylheptanoyl)hydrazinyl]-3-cyano-1-oxopropan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-[2-tert-butyl-2-(3-butyl-2-cyano-7-oxidanyl-7-phenyl-heptanoyl)hydrazinyl]-3-cyano-1-oxidanylidene-propan-2-yl]carbamate
MOLECULAR FORMULA: C34H45N5O5
MOLECULAR WEIGHT: 603.7516
SMILES: CCCCC(CCCC(C1=CC=CC=C1)O)C(C#N)C(=O)N(C(C)(C)C)NC(=O)C(CC#N)NC(=O)OCC2=CC=CC=C2
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