Product OPENEYE NAME: 2-methylnon-3-yne
CAS Name: 2-methyl-3-nonyne
IUPAC NAME: 2-methylnon-3-yne
SYSTEMATIC NAME: 2-methylnon-3-yne
MOLECULAR FORMULA: C10H18
MOLECULAR WEIGHT: 138.24992
SMILES: CCCCCC#CC(C)C
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Product OPENEYE NAME: 3-[2-(6-methylenehexadecylamino)phenyl]prop-2-ynoic acid
CAS Name: 3-[2-(6-methylenehexadecylamino)phenyl]-2-propynoic acid
IUPAC NAME: 3-[2-(6-methylidenehexadecylamino)phenyl]prop-2-ynoic acid
SYSTEMATIC NAME: 3-[2-(6-methylidenehexadecylamino)phenyl]prop-2-ynoic acid
MOLECULAR FORMULA: C26H39NO2
MOLECULAR WEIGHT: 397.59336
SMILES: CCCCCCCCCCC(=C)CCCCCNC1=CC=CC=C1C#CC(=O)O
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Product OPENEYE NAME: methyl 4-[2-(allylamino)phenyl]-4-oxo-butanoate
CAS Name: 4-oxo-4-[2-(prop-2-enylamino)phenyl]butanoic acid methyl ester
IUPAC NAME: methyl 4-oxo-4-[2-(prop-2-enylamino)phenyl]butanoate
SYSTEMATIC NAME: methyl 4-oxidanylidene-4-[2-(prop-2-enylamino)phenyl]butanoate
MOLECULAR FORMULA: C14H17NO3
MOLECULAR WEIGHT: 247.28968
SMILES: COC(=O)CCC(=O)C1=CC=CC=C1NCC=C
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Product OPENEYE NAME: 3-[[(E)-tetradec-4-enyl]amino]benzoyl chloride
CAS Name: 3-[[(E)-tetradec-4-enyl]amino]benzoyl chloride
IUPAC NAME: 3-[[(E)-tetradec-4-enyl]amino]benzoyl chloride
SYSTEMATIC NAME: 3-[[(E)-tetradec-4-enyl]amino]benzoyl chloride
MOLECULAR FORMULA: C21H32ClNO
MOLECULAR WEIGHT: 349.93788
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(=O)Cl
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Product OPENEYE NAME: tert-butyl N-[3-(1H-imidazole-2-carbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate
CAS Name: N-[3-[1H-imidazol-2-yl(oxo)methyl]phenyl]-N-[(E)-pentadec-4-enyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[3-(1H-imidazole-2-carbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[3-(1H-imidazol-2-ylcarbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate
MOLECULAR FORMULA: C30H45N3O3
MOLECULAR WEIGHT: 495.6966
SMILES: CCCCCCCCCC/C=C/CCCN(C1=CC=CC(=C1)C(=O)C2=NC=CN2)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 3-[[(E)-octadec-9-enyl]amino]benzaldehyde
CAS Name: 3-[[(E)-octadec-9-enyl]amino]benzaldehyde
IUPAC NAME: 3-[[(E)-octadec-9-enyl]amino]benzaldehyde
SYSTEMATIC NAME: 3-[[(E)-octadec-9-enyl]amino]benzaldehyde
MOLECULAR FORMULA: C25H41NO
MOLECULAR WEIGHT: 371.59914
SMILES: CCCCCCCC/C=C/CCCCCCCCNC1=CC=CC(=C1)C=O
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Product OPENEYE NAME: 2-[[(E)-pentadec-4-enyl]-(2,2,2-trifluoroacetyl)amino]benzoyl chloride
CAS Name: 2-[[(E)-pentadec-4-enyl]-(2,2,2-trifluoro-1-oxoethyl)amino]benzoyl chloride
IUPAC NAME: 2-[[(E)-pentadec-4-enyl]-(2,2,2-trifluoroacetyl)amino]benzoyl chloride
SYSTEMATIC NAME: 2-[[(E)-pentadec-4-enyl]-[2,2,2-tris(fluoranyl)ethanoyl]amino]benzoyl chloride
MOLECULAR FORMULA: C24H33ClF3NO2
MOLECULAR WEIGHT: 459.97253
SMILES: CCCCCCCCCC/C=C/CCCN(C1=CC=CC=C1C(=O)Cl)C(=O)C(F)(F)F
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Product OPENEYE NAME: 3-pyridyl 2-[[(E)-tetradec-4-enyl]amino]benzoate
CAS Name: 2-[[(E)-tetradec-4-enyl]amino]benzoic acid 3-pyridinyl ester
IUPAC NAME: pyridin-3-yl 2-[[(E)-tetradec-4-enyl]amino]benzoate
SYSTEMATIC NAME: pyridin-3-yl 2-[[(E)-tetradec-4-enyl]amino]benzoate
MOLECULAR FORMULA: C26H36N2O2
MOLECULAR WEIGHT: 408.57624
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(=O)OC2=CN=CC=C2
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Product OPENEYE NAME: 2-[2-[[(E)-tetradec-4-enyl]amino]phenyl]propanoic acid
CAS Name: 2-[2-[[(E)-tetradec-4-enyl]amino]phenyl]propanoic acid
IUPAC NAME: 2-[2-[[(E)-tetradec-4-enyl]amino]phenyl]propanoic acid
SYSTEMATIC NAME: 2-[2-[[(E)-tetradec-4-enyl]amino]phenyl]propanoic acid
MOLECULAR FORMULA: C23H37NO2
MOLECULAR WEIGHT: 359.54538
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(C)C(=O)O
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Product OPENEYE NAME: 2-[3-[[(E)-octadec-9-enyl]amino]phenyl]butanoic acid
CAS Name: 2-[3-[[(E)-octadec-9-enyl]amino]phenyl]butanoic acid
IUPAC NAME: 2-[3-[[(E)-octadec-9-enyl]amino]phenyl]butanoic acid
SYSTEMATIC NAME: 2-[3-[[(E)-octadec-9-enyl]amino]phenyl]butanoic acid
MOLECULAR FORMULA: C28H47NO2
MOLECULAR WEIGHT: 429.67828
SMILES: CCCCCCCC/C=C/CCCCCCCCNC1=CC=CC(=C1)C(CC)C(=O)O
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Product OPENEYE NAME: diethyl 2-[2-[[(E)-tetradec-4-enyl]amino]benzoyl]propanedioate
CAS Name: 2-[oxo-[2-[[(E)-tetradec-4-enyl]amino]phenyl]methyl]propanedioic acid diethyl ester
IUPAC NAME: diethyl 2-[2-[[(E)-tetradec-4-enyl]amino]benzoyl]propanedioate
SYSTEMATIC NAME: diethyl 2-[2-[[(E)-tetradec-4-enyl]amino]phenyl]carbonylpropanedioate
MOLECULAR FORMULA: C28H43NO5
MOLECULAR WEIGHT: 473.64472
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(=O)C(C(=O)OCC)C(=O)OCC
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Product OPENEYE NAME: (E)-3-[3-[[(E)-octadec-9-enyl]amino]phenyl]prop-2-enoic acid
CAS Name: (E)-3-[3-[[(E)-octadec-9-enyl]amino]phenyl]-2-propenoic acid
IUPAC NAME: (E)-3-[3-[[(E)-octadec-9-enyl]amino]phenyl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-[3-[[(E)-octadec-9-enyl]amino]phenyl]prop-2-enoic acid
MOLECULAR FORMULA: C27H43NO2
MOLECULAR WEIGHT: 413.63582
SMILES: CCCCCCCC/C=C/CCCCCCCCNC1=CC=CC(=C1)/C=C/C(=O)O
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Product OPENEYE NAME: (4E)-N-ethylpentadeca-4,14-dien-1-amine
CAS Name: (4E)-N-ethyl-1-pentadeca-4,14-dienamine
IUPAC NAME: (4E)-N-ethylpentadeca-4,14-dien-1-amine
SYSTEMATIC NAME: (4E)-N-ethylpentadeca-4,14-dien-1-amine
MOLECULAR FORMULA: C17H33N
MOLECULAR WEIGHT: 251.45062
SMILES: CCNCCC/C=C/CCCCCCCCC=C
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Product OPENEYE NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]acetyl chloride
CAS Name: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]acetyl chloride
IUPAC NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]acetyl chloride
SYSTEMATIC NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]ethanoyl chloride
MOLECULAR FORMULA: C22H34ClNO
MOLECULAR WEIGHT: 363.96446
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)CC(=O)Cl
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Product OPENEYE NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]butanoic acid
CAS Name: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]butanoic acid
IUPAC NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]butanoic acid
SYSTEMATIC NAME: 2-[3-[[(E)-tetradec-4-enyl]amino]phenyl]butanoic acid
MOLECULAR FORMULA: C24H39NO2
MOLECULAR WEIGHT: 373.57196
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(CC)C(=O)O
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Product OPENEYE NAME: N-(benzenesulfonyl)-2-[[(E)-pentadec-4-enyl]amino]benzamide
CAS Name: N-(benzenesulfonyl)-2-[[(E)-pentadec-4-enyl]amino]benzamide
IUPAC NAME: N-(benzenesulfonyl)-2-[[(E)-pentadec-4-enyl]amino]benzamide
SYSTEMATIC NAME: 2-[[(E)-pentadec-4-enyl]amino]-N-(phenylsulfonyl)benzamide
MOLECULAR FORMULA: C28H40N2O3S
MOLECULAR WEIGHT: 484.6938
SMILES: CCCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(=O)NS(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[[2-[[(E)-tetradec-4-enyl]amino]benzoyl]amino]ethanesulfonic acid
CAS Name: 2-[[oxo-[2-[[(E)-tetradec-4-enyl]amino]phenyl]methyl]amino]ethanesulfonic acid
IUPAC NAME: 2-[[2-[[(E)-tetradec-4-enyl]amino]benzoyl]amino]ethanesulfonic acid
SYSTEMATIC NAME: 2-[[2-[[(E)-tetradec-4-enyl]amino]phenyl]carbonylamino]ethanesulfonic acid
MOLECULAR FORMULA: C23H38N2O4S
MOLECULAR WEIGHT: 438.62382
SMILES: CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C(=O)NCCS(=O)(=O)O
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Product OPENEYE NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-pyrrolidin-1-yl-methanone
CAS Name: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C26H40N2O
MOLECULAR WEIGHT: 396.6086
SMILES: C=CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(=O)N2CCCC2
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Product OPENEYE NAME: octadec-10-yn-1-ol
CAS Name: 10-octadecyn-1-ol
IUPAC NAME: octadec-10-yn-1-ol
SYSTEMATIC NAME: octadec-10-yn-1-ol
MOLECULAR FORMULA: C18H34O
MOLECULAR WEIGHT: 266.46196
SMILES: CCCCCCCC#CCCCCCCCCCO
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Product OPENEYE NAME: 3-[3-[(2-butylcyclopropyl)methylamino]phenyl]propanoic acid
CAS Name: 3-[3-[(2-butylcyclopropyl)methylamino]phenyl]propanoic acid
IUPAC NAME: 3-[3-[(2-butylcyclopropyl)methylamino]phenyl]propanoic acid
SYSTEMATIC NAME: 3-[3-[(2-butylcyclopropyl)methylamino]phenyl]propanoic acid
MOLECULAR FORMULA: C17H25NO2
MOLECULAR WEIGHT: 275.3859
SMILES: CCCCC1CC1CNC2=CC=CC(=C2)CCC(=O)O
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Product OPENEYE NAME: O1-tert-butyl O3-ethyl 2-[3-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]propanedioate
CAS Name: 2-[oxo-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]methyl]propanedioic acid O3-tert-butyl ester O1-ethyl ester
IUPAC NAME: 3-O-tert-butyl 1-O-ethyl 2-[3-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]propanedioate
SYSTEMATIC NAME: O3-tert-butyl O1-ethyl 2-[3-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]carbonylpropanedioate
MOLECULAR FORMULA: C31H47NO5
MOLECULAR WEIGHT: 513.70858
SMILES: CCOC(=O)C(C(=O)C1=CC(=CC=C1)NCCC/C=C/CCCCCCCCC=C)C(=O)OC(C)(C)C
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Product OPENEYE NAME: (4E,8E)-6-methyldodeca-1,4,8,11-tetraene
CAS Name: (4E,8E)-6-methyldodeca-1,4,8,11-tetraene
IUPAC NAME: (4E,8E)-6-methyldodeca-1,4,8,11-tetraene
SYSTEMATIC NAME: (4E,8E)-6-methyldodeca-1,4,8,11-tetraene
MOLECULAR FORMULA: C13H20
MOLECULAR WEIGHT: 176.2979
SMILES: CC(C/C=C/CC=C)/C=C/CC=C
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Product OPENEYE NAME: 3-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]prop-2-ynoic acid
CAS Name: 3-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]-2-propynoic acid
IUPAC NAME: 3-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]prop-2-ynoic acid
SYSTEMATIC NAME: 3-[2-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]prop-2-ynoic acid
MOLECULAR FORMULA: C24H33NO2
MOLECULAR WEIGHT: 367.52432
SMILES: C=CCCCCCCCC/C=C/CCCNC1=CC=CC=C1C#CC(=O)O
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Product OPENEYE NAME: 1-butyl-2-(iodomethyl)cyclopropane
CAS Name: 1-butyl-2-(iodomethyl)cyclopropane
IUPAC NAME: 1-butyl-2-(iodomethyl)cyclopropane
SYSTEMATIC NAME: 1-butyl-2-(iodanylmethyl)cyclopropane
MOLECULAR FORMULA: C8H15I
MOLECULAR WEIGHT: 238.10917
SMILES: CCCCC1CC1CI
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