Wednesday, July 31, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-(1-piperidyl)methanone
CAS Name: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-(1-piperidinyl)methanone
IUPAC NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-piperidin-1-ylmethanone
SYSTEMATIC NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-piperidin-1-yl-methanone
MOLECULAR FORMULA: C27H42N2O
MOLECULAR WEIGHT: 410.63518
SMILES: C=CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(=O)N2CCCCC2
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Product OPENEYE NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride hydrochloride
CAS Name: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride hydrochloride
IUPAC NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride hydrochloride
SYSTEMATIC NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]ethanoyl chloride hydrochloride
MOLECULAR FORMULA: C23H37Cl2NO
MOLECULAR WEIGHT: 414.45198
SMILES: CCCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)CC(=O)Cl.Cl
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Product OPENEYE NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride
CAS Name: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride
IUPAC NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]acetyl chloride
SYSTEMATIC NAME: 2-[3-[[(E)-pentadec-4-enyl]amino]phenyl]ethanoyl chloride
MOLECULAR FORMULA: C23H36ClNO
MOLECULAR WEIGHT: 377.99104
SMILES: CCCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)CC(=O)Cl
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Product OPENEYE NAME: 2-(benzenesulfinyl)-1-[2-(1-cyclopentylethylamino)phenyl]ethanone
CAS Name: 2-(benzenesulfinyl)-1-[2-(1-cyclopentylethylamino)phenyl]ethanone
IUPAC NAME: 2-(benzenesulfinyl)-1-[2-(1-cyclopentylethylamino)phenyl]ethanone
SYSTEMATIC NAME: 1-[2-(1-cyclopentylethylamino)phenyl]-2-(phenylsulfinyl)ethanone
MOLECULAR FORMULA: C21H25NO2S
MOLECULAR WEIGHT: 355.4937
SMILES: CC(C1CCCC1)NC2=CC=CC=C2C(=O)CS(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[2-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]oxybutanedioic acid
CAS Name: 2-[oxo-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]methoxy]butanedioic acid
IUPAC NAME: 2-[2-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]oxybutanedioic acid
SYSTEMATIC NAME: 2-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]carbonyloxybutanedioic acid
MOLECULAR FORMULA: C26H37NO6
MOLECULAR WEIGHT: 459.57508
SMILES: C=CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(=O)OC(CC(=O)O)C(=O)O
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Product OPENEYE NAME: octadec-7-yn-1-ol
CAS Name: 7-octadecyn-1-ol
IUPAC NAME: octadec-7-yn-1-ol
SYSTEMATIC NAME: octadec-7-yn-1-ol
MOLECULAR FORMULA: C18H34O
MOLECULAR WEIGHT: 266.46196
SMILES: CCCCCCCCCCC#CCCCCCCO
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Product OPENEYE NAME: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxo-butanoic acid
CAS Name: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxobutanoic acid
IUPAC NAME: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C18H25NO3
MOLECULAR WEIGHT: 303.396
SMILES: CCCC(C1CC1C)NC2=CC=CC(=C2)C(=O)CCC(=O)O
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Product OPENEYE NAME: ethyl 3-[2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]phenyl]propanoate
CAS Name: 3-[2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]phenyl]propanoic acid ethyl ester
IUPAC NAME: ethyl 3-[2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]phenyl]propanoate
SYSTEMATIC NAME: ethyl 3-[2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]phenyl]propanoate
MOLECULAR FORMULA: C26H39NO2
MOLECULAR WEIGHT: 397.59336
SMILES: CCOC(=O)CCC1=CC=CC=C1NC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C
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Product OPENEYE NAME: 1-[3-[[(E)-tetradec-4-enyl]amino]phenyl]ethanone
CAS Name: 1-[3-[[(E)-tetradec-4-enyl]amino]phenyl]ethanone
IUPAC NAME: 1-[3-[[(E)-tetradec-4-enyl]amino]phenyl]ethanone
SYSTEMATIC NAME: 1-[3-[[(E)-tetradec-4-enyl]amino]phenyl]ethanone
MOLECULAR FORMULA: C22H35NO
MOLECULAR WEIGHT: 329.5194
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(=O)C
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Product OPENEYE NAME: 2-[3-[(2-butylcyclopropyl)methylamino]phenyl]butanoic acid
CAS Name: 2-[3-[(2-butylcyclopropyl)methylamino]phenyl]butanoic acid
IUPAC NAME: 2-[3-[(2-butylcyclopropyl)methylamino]phenyl]butanoic acid
SYSTEMATIC NAME: 2-[3-[(2-butylcyclopropyl)methylamino]phenyl]butanoic acid
MOLECULAR FORMULA: C18H27NO2
MOLECULAR WEIGHT: 289.41248
SMILES: CCCCC1CC1CNC2=CC=CC(=C2)C(CC)C(=O)O
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Product OPENEYE NAME: 3-[3-(allylamino)benzoyl]pentane-2,4-dione
CAS Name: 3-[oxo-[3-(prop-2-enylamino)phenyl]methyl]pentane-2,4-dione
IUPAC NAME: 3-[3-(prop-2-enylamino)benzoyl]pentane-2,4-dione
SYSTEMATIC NAME: 3-[3-(prop-2-enylamino)phenyl]carbonylpentane-2,4-dione
MOLECULAR FORMULA: C15H17NO3
MOLECULAR WEIGHT: 259.30038
SMILES: CC(=O)C(C(=O)C)C(=O)C1=CC(=CC=C1)NCC=C
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Product OPENEYE NAME: 2-(allylamino)benzaldehyde
CAS Name: 2-(prop-2-enylamino)benzaldehyde
IUPAC NAME: 2-(prop-2-enylamino)benzaldehyde
SYSTEMATIC NAME: 2-(prop-2-enylamino)benzaldehyde
MOLECULAR FORMULA: C10H11NO
MOLECULAR WEIGHT: 161.20044
SMILES: C=CCNC1=CC=CC=C1C=O
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Product OPENEYE NAME: 3-[2-[[(E)-hept-3-enyl]amino]phenyl]-3-oxo-propanoic acid
CAS Name: 3-[2-[[(E)-hept-3-enyl]amino]phenyl]-3-oxopropanoic acid
IUPAC NAME: 3-[2-[[(E)-hept-3-enyl]amino]phenyl]-3-oxopropanoic acid
SYSTEMATIC NAME: 3-[2-[[(E)-hept-3-enyl]amino]phenyl]-3-oxidanylidene-propanoic acid
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: CCC/C=C/CCNC1=CC=CC=C1C(=O)CC(=O)O
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Product OPENEYE NAME: (E)-3-[2-[(2-butylcyclopropyl)methylamino]phenyl]prop-2-enoic acid
CAS Name: (E)-3-[2-[(2-butylcyclopropyl)methylamino]phenyl]-2-propenoic acid
IUPAC NAME: (E)-3-[2-[(2-butylcyclopropyl)methylamino]phenyl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-[2-[(2-butylcyclopropyl)methylamino]phenyl]prop-2-enoic acid
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CCCCC1CC1CNC2=CC=CC=C2/C=C/C(=O)O
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Product OPENEYE NAME: diethyl 2-[2-[2-(allylamino)phenyl]acetyl]oxy-3-hydroxy-butanedioate
CAS Name: 2-hydroxy-3-[1-oxo-2-[2-(prop-2-enylamino)phenyl]ethoxy]butanedioic acid diethyl ester
IUPAC NAME: diethyl 2-hydroxy-3-[2-[2-(prop-2-enylamino)phenyl]acetyl]oxybutanedioate
SYSTEMATIC NAME: diethyl 2-oxidanyl-3-[2-[2-(prop-2-enylamino)phenyl]ethanoyloxy]butanedioate
MOLECULAR FORMULA: C19H25NO7
MOLECULAR WEIGHT: 379.4043
SMILES: CCOC(=O)C(C(C(=O)OCC)OC(=O)CC1=CC=CC=C1NCC=C)O
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Product OPENEYE NAME: 1-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]ethanone
CAS Name: 1-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]ethanone
IUPAC NAME: 1-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]ethanone
SYSTEMATIC NAME: 1-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]ethanone
MOLECULAR FORMULA: C23H35NO
MOLECULAR WEIGHT: 341.5301
SMILES: CC(=O)C1=CC(=CC=C1)NCCC/C=C/CCCCCCCCC=C
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Product OPENEYE NAME: 2-[(2-butylcyclopropyl)methylamino]benzonitrile
CAS Name: 2-[(2-butylcyclopropyl)methylamino]benzonitrile
IUPAC NAME: 2-[(2-butylcyclopropyl)methylamino]benzonitrile
SYSTEMATIC NAME: 2-[(2-butylcyclopropyl)methylamino]benzenecarbonitrile
MOLECULAR FORMULA: C15H20N2
MOLECULAR WEIGHT: 228.3327
SMILES: CCCCC1CC1CNC2=CC=CC=C2C#N
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Product OPENEYE NAME: benzyl 2-[3-(2-chloro-2-oxo-ethyl)anilino]but-3-enoate
CAS Name: 2-[3-(2-chloro-2-oxoethyl)anilino]-3-butenoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 2-[3-(2-chloro-2-oxoethyl)anilino]but-3-enoate
SYSTEMATIC NAME: (phenylmethyl) 2-[[3-(2-chloranyl-2-oxidanylidene-ethyl)phenyl]amino]but-3-enoate
MOLECULAR FORMULA: C19H18ClNO3
MOLECULAR WEIGHT: 343.80412
SMILES: C=CC(C(=O)OCC1=CC=CC=C1)NC2=CC=CC(=C2)CC(=O)Cl
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Product OPENEYE NAME: ethyl 2-[3-(allylamino)benzoyl]-3-oxo-butanoate
CAS Name: 3-oxo-2-[oxo-[3-(prop-2-enylamino)phenyl]methyl]butanoic acid ethyl ester
IUPAC NAME: ethyl 3-oxo-2-[3-(prop-2-enylamino)benzoyl]butanoate
SYSTEMATIC NAME: ethyl 3-oxidanylidene-2-[3-(prop-2-enylamino)phenyl]carbonyl-butanoate
MOLECULAR FORMULA: C16H19NO4
MOLECULAR WEIGHT: 289.32636
SMILES: CCOC(=O)C(C(=O)C)C(=O)C1=CC(=CC=C1)NCC=C
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Product OPENEYE NAME: 2-[[(E)-pentadec-4-enyl]amino]benzonitrile
CAS Name: 2-[[(E)-pentadec-4-enyl]amino]benzonitrile
IUPAC NAME: 2-[[(E)-pentadec-4-enyl]amino]benzonitrile
SYSTEMATIC NAME: 2-[[(E)-pentadec-4-enyl]amino]benzenecarbonitrile
MOLECULAR FORMULA: C22H34N2
MOLECULAR WEIGHT: 326.51876
SMILES: CCCCCCCCCC/C=C/CCCNC1=CC=CC=C1C#N
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Product OPENEYE NAME: 3-(allylamino)benzaldehyde
CAS Name: 3-(prop-2-enylamino)benzaldehyde
IUPAC NAME: 3-(prop-2-enylamino)benzaldehyde
SYSTEMATIC NAME: 3-(prop-2-enylamino)benzaldehyde
MOLECULAR FORMULA: C10H11NO
MOLECULAR WEIGHT: 161.20044
SMILES: C=CCNC1=CC=CC(=C1)C=O
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