Thursday, June 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 4-[2-[3-[(2-benzoylhydrazino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(benzoylhydrazo)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(2-benzoylhydrazinyl)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[[2-(phenylcarbonyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C23H26N2O4
MOLECULAR WEIGHT: 394.46354
SMILES: C1CC2C(C(C1O2)CCC3=CC=C(C=C3)C(=O)O)CNNC(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[[3-[(E)-(2-oxohexylhydrazono)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
CAS Name: 4-[[3-[(E)-(2-oxohexylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
IUPAC NAME: 4-[[3-[(E)-(2-oxohexylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[3-[(E)-(2-oxidanylidenehexylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
MOLECULAR FORMULA: C21H28N2O4
MOLECULAR WEIGHT: 372.45802
SMILES: CCCCC(=O)CN/N=C/C1C2CCC(C1CC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[2-[3-[(E)-3-hydroxy-4-phenyl-hex-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-3-hydroxy-4-phenylhex-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-3-hydroxy-4-phenylhex-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-3-oxidanyl-4-phenyl-hex-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C27H32O4
MOLECULAR WEIGHT: 420.54058
SMILES: CCC(C1=CC=CC=C1)C(/C=C/C2C3CCC(C2CCC4=CC=C(C=C4)C(=O)O)O3)O
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Product OPENEYE NAME: 4-[2-[3-[(E)-(propoxycarbonylhydrazono)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-[[oxo(propoxy)methyl]hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-(propoxycarbonylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-(propoxycarbonylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C20H26N2O5
MOLECULAR WEIGHT: 374.43084
SMILES: CCCOC(=O)N/N=C/C1C2CCC(C1CCC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: [2-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-3-yl]-(4-vinylphenyl)methanol
CAS Name: (4-ethenylphenyl)-[2-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-3-yl]methanol
IUPAC NAME: (4-ethenylphenyl)-[2-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-3-yl]methanol
SYSTEMATIC NAME: (4-ethenylphenyl)-[2-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-3-yl]methanol
MOLECULAR FORMULA: C16H20O3
MOLECULAR WEIGHT: 260.3282
SMILES: C=CC1=CC=C(C=C1)C(C2C3CCC(C2CO)O3)O
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Product OPENEYE NAME: 4-[2-[3-[[2-(2-amino-3-phenyl-propanoyl)hydrazino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[[(2-amino-1-oxo-3-phenylpropyl)hydrazo]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[[2-(2-amino-3-phenylpropanoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[[2-(2-azanyl-3-phenyl-propanoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C25H31N3O4
MOLECULAR WEIGHT: 437.53134
SMILES: C1CC2C(C(C1O2)CCC3=CC=C(C=C3)C(=O)O)CNNC(=O)C(CC4=CC=CC=C4)N
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Product OPENEYE NAME: 4-[2-[3-[(E)-hexoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-hexoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-hexoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-hexoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C22H31NO4
MOLECULAR WEIGHT: 373.48584
SMILES: CCCCCCO/N=C/C1C2CCC(C1CCC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[2-[3-[(E)-[benzoyl(ethyl)hydrazono]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-[benzoyl(ethyl)hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-[benzoyl(ethyl)hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-[ethyl(phenylcarbonyl)hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C25H28N2O4
MOLECULAR WEIGHT: 420.50082
SMILES: CCN(C(=O)C1=CC=CC=C1)/N=C/C2C3CCC(C2CCC4=CC=C(C=C4)C(=O)O)O3
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Product OPENEYE NAME: 4-[2-[3-[[2-(propylcarbamoyl)hydrazino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[[[oxo(propylamino)methyl]hydrazo]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[[2-(propylcarbamoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[[2-(propylcarbamoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C20H29N3O4
MOLECULAR WEIGHT: 375.46196
SMILES: CCCNC(=O)NNCC1C2CCC(C1CCC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[2-[3-[(E)-4-methyl-3-oxo-4-phenyl-pent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-4-methyl-3-oxo-4-phenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-4-methyl-3-oxo-4-phenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-4-methyl-3-oxidanylidene-4-phenyl-pent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C27H30O4
MOLECULAR WEIGHT: 418.5247
SMILES: CC(C)(C1=CC=CC=C1)C(=O)/C=C/C2C3CCC(C2CCC4=CC=C(C=C4)C(=O)O)O3
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Product OPENEYE NAME: 4-[2-[3-[(benzylamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[[(phenylmethyl)amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(benzylamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[[(phenylmethyl)amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C23H27NO3
MOLECULAR WEIGHT: 365.46538
SMILES: C1CC2C(C(C1O2)CCC3=CC=C(C=C3)C(=O)O)CNCC4=CC=CC=C4
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Product OPENEYE NAME: 4-[[3-(2-anilino-2-oxo-ethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
CAS Name: 4-[[3-(2-anilino-2-oxoethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
IUPAC NAME: 4-[[3-(2-anilino-2-oxoethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[3-(2-oxidanylidene-2-phenylazanyl-ethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
MOLECULAR FORMULA: C22H23NO4
MOLECULAR WEIGHT: 365.42232
SMILES: C1CC2C(C(C1O2)CC3=CC=C(C=C3)C(=O)O)CC(=O)NC4=CC=CC=C4
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Product OPENEYE NAME: 4-[[3-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
CAS Name: 4-[[3-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
IUPAC NAME: 4-[[3-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[3-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
MOLECULAR FORMULA: C15H18O4
MOLECULAR WEIGHT: 262.30102
SMILES: C1CC2C(C(C1O2)CC3=CC=C(C=C3)C(=O)O)CO
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Product OPENEYE NAME: 4-[2-[3-[(E)-pentoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-pentoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-pentoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-pentoxyiminomethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C21H29NO4
MOLECULAR WEIGHT: 359.45926
SMILES: CCCCCO/N=C/C1C2CCC(C1CCC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[2-[3-[(E)-3-hydroxy-4-(m-tolyl)but-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-3-hydroxy-4-(3-methylphenyl)but-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-3-hydroxy-4-(3-methylphenyl)but-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-4-(3-methylphenyl)-3-oxidanyl-but-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C26H30O4
MOLECULAR WEIGHT: 406.514
SMILES: CC1=CC(=CC=C1)CC(/C=C/C2C3CCC(C2CCC4=CC=C(C=C4)C(=O)O)O3)O
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Product OPENEYE NAME: 4-[2-[3-[(E)-(pentanoylhydrazono)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-(1-oxopentylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-(pentanoylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-(pentanoylhydrazinylidene)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C21H28N2O4
MOLECULAR WEIGHT: 372.45802
SMILES: CCCCC(=O)N/N=C/C1C2CCC(C1CCC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[[3-[(pentoxyamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
CAS Name: 4-[[3-[(pentoxyamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
IUPAC NAME: 4-[[3-[(pentoxyamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[3-[(pentoxyamino)methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
MOLECULAR FORMULA: C20H29NO4
MOLECULAR WEIGHT: 347.44856
SMILES: CCCCCONCC1C2CCC(C1CC3=CC=C(C=C3)C(=O)O)O2
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Product OPENEYE NAME: 4-[2-[3-[(Z)-3-hydroxy-1,4-diphenyl-pent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(Z)-3-hydroxy-1,4-diphenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(Z)-3-hydroxy-1,4-diphenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(Z)-3-oxidanyl-1,4-diphenyl-pent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C32H34O4
MOLECULAR WEIGHT: 482.60996
SMILES: CC(C1=CC=CC=C1)C(/C=C(/C2C3CCC(C2CCC4=CC=C(C=C4)C(=O)O)O3)\C5=CC=CC=C5)O
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Product OPENEYE NAME: 4-[2-[3-[(E)-[[2-oxo-2-(3-pyridyl)ethyl]hydrazono]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
CAS Name: 4-[2-[3-[(E)-[[2-oxo-2-(3-pyridinyl)ethyl]hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[3-[(E)-[(2-oxo-2-pyridin-3-ylethyl)hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[3-[(E)-[(2-oxidanylidene-2-pyridin-3-yl-ethyl)hydrazinylidene]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C23H25N3O4
MOLECULAR WEIGHT: 407.4623
SMILES: C1CC2C(C(C1O2)CCC3=CC=C(C=C3)C(=O)O)/C=N/NCC(=O)C4=CN=CC=C4
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Product OPENEYE NAME: N-hexylhydroxylamine hydrochloride
CAS Name: N-hexylhydroxylamine hydrochloride
IUPAC NAME: N-hexylhydroxylamine hydrochloride
SYSTEMATIC NAME: N-hexylhydroxylamine hydrochloride
MOLECULAR FORMULA: C6H16ClNO
MOLECULAR WEIGHT: 153.65034
SMILES: CCCCCCNO.Cl
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Product OPENEYE NAME: 4-[[3-[(E)-3-cyclohexyl-3-oxo-prop-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
CAS Name: 4-[[3-[(E)-3-cyclohexyl-3-oxoprop-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
IUPAC NAME: 4-[[3-[(E)-3-cyclohexyl-3-oxoprop-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[3-[(E)-3-cyclohexyl-3-oxidanylidene-prop-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid
MOLECULAR FORMULA: C23H28O4
MOLECULAR WEIGHT: 368.46602
SMILES: C1CCC(CC1)C(=O)/C=C/C2C3CCC(C2CC4=CC=C(C=C4)C(=O)O)O3
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