Tuesday, August 6, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[1-carboxyethoxy(sulfanyl)phosphinothioyl]oxypropanoic acid
CAS Name: 2-[1-carboxyethoxy(mercapto)phosphinothioyl]oxypropanoic acid
IUPAC NAME: 2-[1-carboxyethoxy(sulfanyl)phosphinothioyl]oxypropanoic acid
SYSTEMATIC NAME: 2-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-sulfanyl-phosphinothioyl]oxypropanoic acid
MOLECULAR FORMULA: C6H11O6PS2
MOLECULAR WEIGHT: 274.251701
SMILES: CC(C(=O)O)OP(=S)(OC(C)C(=O)O)S
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Product OPENEYE NAME: zinc 2-hydroxybutanoate
CAS Name: zinc 2-hydroxybutanoate
IUPAC NAME: zinc 2-hydroxybutanoate
SYSTEMATIC NAME: zinc 2-oxidanylbutanoate
MOLECULAR FORMULA: C8H14O6Zn
MOLECULAR WEIGHT: 271.60216
SMILES: CCC(C(=O)[O-])O.CCC(C(=O)[O-])O.[Zn+2]
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Product OPENEYE NAME: zinc 2-hydroxy-3-methyl-pentanoate
CAS Name: zinc 2-hydroxy-3-methylpentanoate
IUPAC NAME: zinc 2-hydroxy-3-methylpentanoate
SYSTEMATIC NAME: zinc 3-methyl-2-oxidanyl-pentanoate
MOLECULAR FORMULA: C12H22O6Zn
MOLECULAR WEIGHT: 327.70848
SMILES: CCC(C)C(C(=O)[O-])O.CCC(C)C(C(=O)[O-])O.[Zn+2]
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Product OPENEYE NAME: zinc ethyl 2-hydroxyacetate
CAS Name: zinc 2-hydroxyacetic acid ethyl ester
IUPAC NAME: zinc ethyl 2-hydroxyacetate
SYSTEMATIC NAME: zinc ethyl 2-oxidanylethanoate
MOLECULAR FORMULA: C8H16O6Zn+2
MOLECULAR WEIGHT: 273.61804
SMILES: CCOC(=O)CO.CCOC(=O)CO.[Zn+2]
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Product OPENEYE NAME: zinc butyl 2-hydroxyacetate
CAS Name: zinc 2-hydroxyacetic acid butyl ester
IUPAC NAME: zinc butyl 2-hydroxyacetate
SYSTEMATIC NAME: zinc butyl 2-oxidanylethanoate
MOLECULAR FORMULA: C12H24O6Zn+2
MOLECULAR WEIGHT: 329.72436
SMILES: CCCCOC(=O)CO.CCCCOC(=O)CO.[Zn+2]
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Product OPENEYE NAME: zinc isopropyl 2-hydroxyacetate
CAS Name: zinc 2-hydroxyacetic acid propan-2-yl ester
IUPAC NAME: zinc propan-2-yl 2-hydroxyacetate
SYSTEMATIC NAME: zinc propan-2-yl 2-oxidanylethanoate
MOLECULAR FORMULA: C10H20O6Zn+2
MOLECULAR WEIGHT: 301.6712
SMILES: CC(C)OC(=O)CO.CC(C)OC(=O)CO.[Zn+2]
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Product OPENEYE NAME: zinc 4-ethyl-2-hydroxy-octanoate
CAS Name: zinc 4-ethyl-2-hydroxyoctanoate
IUPAC NAME: zinc 4-ethyl-2-hydroxyoctanoate
SYSTEMATIC NAME: zinc 4-ethyl-2-oxidanyl-octanoate
MOLECULAR FORMULA: C20H38O6Zn
MOLECULAR WEIGHT: 439.92112
SMILES: CCCCC(CC)CC(C(=O)[O-])O.CCCCC(CC)CC(C(=O)[O-])O.[Zn+2]
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Product OPENEYE NAME: 4-ethyl-2-hydroxy-octanoic acid
CAS Name: 4-ethyl-2-hydroxyoctanoic acid
IUPAC NAME: 4-ethyl-2-hydroxyoctanoic acid
SYSTEMATIC NAME: 4-ethyl-2-oxidanyl-octanoic acid
MOLECULAR FORMULA: C10H20O3
MOLECULAR WEIGHT: 188.264
SMILES: CCCCC(CC)CC(C(=O)O)O
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Product OPENEYE NAME: 1,4-bis(4-butyl-N-methyl-anilino)anthracene-9,10-dione
CAS Name: 1,4-bis(4-butyl-N-methylanilino)anthracene-9,10-dione
IUPAC NAME: 1,4-bis(4-butyl-N-methylanilino)anthracene-9,10-dione
SYSTEMATIC NAME: 1,4-bis[(4-butylphenyl)-methyl-amino]anthracene-9,10-dione
MOLECULAR FORMULA: C36H38N2O2
MOLECULAR WEIGHT: 530.69912
SMILES: CCCCC1=CC=C(C=C1)N(C)C2=C3C(=C(C=C2)N(C)C4=CC=C(C=C4)CCCC)C(=O)C5=CC=CC=C5C3=O
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Product OPENEYE NAME: 1,6-bis(2,6-diethyl-4-methyl-anilino)anthracene-9,10-dione
CAS Name: 1,6-bis(2,6-diethyl-4-methylanilino)anthracene-9,10-dione
IUPAC NAME: 1,6-bis(2,6-diethyl-4-methylanilino)anthracene-9,10-dione
SYSTEMATIC NAME: 1,6-bis[(2,6-diethyl-4-methyl-phenyl)amino]anthracene-9,10-dione
MOLECULAR FORMULA: C36H38N2O2
MOLECULAR WEIGHT: 530.69912
SMILES: CCC1=CC(=CC(=C1NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC=C4NC5=C(C=C(C=C5CC)C)CC)CC)C
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Product OPENEYE NAME: 2-ethylhexyl($l^{1}-silanyloxy)silicon
CAS Name: 2-ethylhexyl($l^{1}-silanyloxy)silicon
IUPAC NAME: 2-ethylhexyl($l^{1}-silanyloxy)silicon
SYSTEMATIC NAME: 2-ethylhexyl($l^{1}-silanyloxy)silicon
MOLECULAR FORMULA: C8H17OSi2
MOLECULAR WEIGHT: 185.39098
SMILES: CCCCC(CC)C[Si]O[Si]
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Product OPENEYE NAME: 2-ethylhexyl-($l^{1}-silanyloxy-$l^{2}-silanyl)oxy-silicon
CAS Name: 2-ethylhexyl-($l^{1}-silanyloxy-$l^{2}-silanyl)oxysilicon
IUPAC NAME: 2-ethylhexyl-($l^{1}-silanyloxy-$l^{2}-silanyl)oxysilicon
SYSTEMATIC NAME: 2-ethylhexyl-($l^{1}-silanyloxy-$l^{2}-silanyl)oxy-silicon
MOLECULAR FORMULA: C8H17O2Si3
MOLECULAR WEIGHT: 229.47588
SMILES: CCCCC(CC)C[Si]O[Si]O[Si]
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Product OPENEYE NAME: calcium magnesium dinitrate
CAS Name: calcium magnesium dinitrate
IUPAC NAME: calcium magnesium dinitrate
SYSTEMATIC NAME: calcium magnesium dinitrate
MOLECULAR FORMULA: CaMgN2O6+2
MOLECULAR WEIGHT: 188.3928
SMILES: [N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Mg+2].[Ca+2]
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Product OPENEYE NAME: 2,3,4-trihydroxybutyl octadecanoate
CAS Name: octadecanoic acid 2,3,4-trihydroxybutyl ester
IUPAC NAME: 2,3,4-trihydroxybutyl octadecanoate
SYSTEMATIC NAME: 2,3,4-tris(oxidanyl)butyl octadecanoate
MOLECULAR FORMULA: C22H44O5
MOLECULAR WEIGHT: 388.58176
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(C(CO)O)O
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Product OPENEYE NAME: 2,3,4-trihydroxybutyl dodecanoate
CAS Name: dodecanoic acid 2,3,4-trihydroxybutyl ester
IUPAC NAME: 2,3,4-trihydroxybutyl dodecanoate
SYSTEMATIC NAME: 2,3,4-tris(oxidanyl)butyl dodecanoate
MOLECULAR FORMULA: C16H32O5
MOLECULAR WEIGHT: 304.42228
SMILES: CCCCCCCCCCCC(=O)OCC(C(CO)O)O
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Product OPENEYE NAME: 2,3,4,5-tetrahydroxypentyl (E)-octadec-9-enoate
CAS Name: (E)-9-octadecenoic acid 2,3,4,5-tetrahydroxypentyl ester
IUPAC NAME: 2,3,4,5-tetrahydroxypentyl (E)-octadec-9-enoate
SYSTEMATIC NAME: 2,3,4,5-tetrakis(oxidanyl)pentyl (E)-octadec-9-enoate
MOLECULAR FORMULA: C23H44O6
MOLECULAR WEIGHT: 416.59186
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC(C(C(CO)O)O)O
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Product OPENEYE NAME: 12-hydroxy-11,11-bis(hydroxymethyl)dodecanoic acid
CAS Name: 12-hydroxy-11,11-bis(hydroxymethyl)dodecanoic acid
IUPAC NAME: 12-hydroxy-11,11-bis(hydroxymethyl)dodecanoic acid
SYSTEMATIC NAME: 11,11-bis(hydroxymethyl)-12-oxidanyl-dodecanoic acid
MOLECULAR FORMULA: C14H28O5
MOLECULAR WEIGHT: 276.36912
SMILES: C(CCCCC(=O)O)CCCCC(CO)(CO)CO
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Product OPENEYE NAME: 1-[nonoxy(nonyl)phosphoryl]oxynonane
CAS Name: 1-[nonoxy(nonyl)phosphoryl]oxynonane
IUPAC NAME: 1-[nonoxy(nonyl)phosphoryl]oxynonane
SYSTEMATIC NAME: 1-[nonoxy(nonyl)phosphoryl]oxynonane
MOLECULAR FORMULA: C27H57O3P
MOLECULAR WEIGHT: 460.713441
SMILES: CCCCCCCCCOP(=O)(CCCCCCCCC)OCCCCCCCCC
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Product OPENEYE NAME: 3-(diethylamino)cyclohexa-2,4-dien-1-one
CAS Name: 3-(diethylamino)-1-cyclohexa-2,4-dienone
IUPAC NAME: 3-(diethylamino)cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 3-(diethylamino)cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C10H15NO
MOLECULAR WEIGHT: 165.2322
SMILES: CCN(CC)C1=CC(=O)CC=C1
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Product OPENEYE NAME: 2-[(3-amino-4-hydroxy-1-naphthyl)sulfonylamino]ethanesulfonic acid
CAS Name: 2-[(3-amino-4-hydroxy-1-naphthalenyl)sulfonylamino]ethanesulfonic acid
IUPAC NAME: 2-[(3-amino-4-hydroxynaphthalen-1-yl)sulfonylamino]ethanesulfonic acid
SYSTEMATIC NAME: 2-[(3-azanyl-4-oxidanyl-naphthalen-1-yl)sulfonylamino]ethanesulfonic acid
MOLECULAR FORMULA: C12H14N2O6S2
MOLECULAR WEIGHT: 346.37936
SMILES: C1=CC=C2C(=C1)C(=CC(=C2O)N)S(=O)(=O)NCCS(=O)(=O)O
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Product OPENEYE NAME: 4-[(5-amino-6-hydroxy-2-naphthyl)sulfonylamino]benzenesulfonic acid
CAS Name: 4-[(5-amino-6-hydroxy-2-naphthalenyl)sulfonylamino]benzenesulfonic acid
IUPAC NAME: 4-[(5-amino-6-hydroxynaphthalen-2-yl)sulfonylamino]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(5-azanyl-6-oxidanyl-naphthalen-2-yl)sulfonylamino]benzenesulfonic acid
MOLECULAR FORMULA: C16H14N2O6S2
MOLECULAR WEIGHT: 394.42216
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)C(=C(C=C3)O)N)S(=O)(=O)O
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Product OPENEYE NAME: 4-[(5-amino-6-methoxy-2-naphthyl)sulfonylamino]benzenesulfonic acid
CAS Name: 4-[(5-amino-6-methoxy-2-naphthalenyl)sulfonylamino]benzenesulfonic acid
IUPAC NAME: 4-[(5-amino-6-methoxynaphthalen-2-yl)sulfonylamino]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(5-azanyl-6-methoxy-naphthalen-2-yl)sulfonylamino]benzenesulfonic acid
MOLECULAR FORMULA: C17H16N2O6S2
MOLECULAR WEIGHT: 408.44874
SMILES: COC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)O)N
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Product OPENEYE NAME: 4-[(4-amino-3-hydroxy-phenyl)methyl-sulfino-amino]benzenesulfonic acid
CAS Name: 4-[(4-amino-3-hydroxyphenyl)methyl-sulfinoamino]benzenesulfonic acid
IUPAC NAME: 4-[(4-amino-3-hydroxyphenyl)methyl-sulfinoamino]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(4-azanyl-3-oxidanyl-phenyl)methyl-sulfino-amino]benzenesulfonic acid
MOLECULAR FORMULA: C13H14N2O6S2
MOLECULAR WEIGHT: 358.39006
SMILES: C1=CC(=CC=C1N(CC2=CC(=C(C=C2)N)O)S(=O)O)S(=O)(=O)O
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