Product OPENEYE NAME: (E)-4-hydroxy-4-propoxy-but-3-en-2-one
CAS Name: (E)-4-hydroxy-4-propoxy-3-buten-2-one
IUPAC NAME: (E)-4-hydroxy-4-propoxybut-3-en-2-one
SYSTEMATIC NAME: (E)-4-oxidanyl-4-propoxy-but-3-en-2-one
MOLECULAR FORMULA: C7H12O3
MOLECULAR WEIGHT: 144.16838
SMILES: CCCO/C(=C/C(=O)C)/O
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Product OPENEYE NAME: 1-ethyl-6-hydroxy-4-methyl-pyridin-2-one
CAS Name: 1-ethyl-6-hydroxy-4-methyl-2-pyridinone
IUPAC NAME: 1-ethyl-6-hydroxy-4-methylpyridin-2-one
SYSTEMATIC NAME: 1-ethyl-4-methyl-6-oxidanyl-pyridin-2-one
MOLECULAR FORMULA: C8H11NO2
MOLECULAR WEIGHT: 153.17844
SMILES: CCN1C(=CC(=CC1=O)C)O
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Product OPENEYE NAME: (4Z)-4-[(5-chloro-2-hydroxy-phenyl)hydrazono]-3-oxo-N-phenyl-naphthalene-2-carboxamide
CAS Name: (4Z)-4-[(5-chloro-2-hydroxyphenyl)hydrazinylidene]-3-oxo-N-phenyl-2-naphthalenecarboxamide
IUPAC NAME: (4Z)-4-[(5-chloro-2-hydroxyphenyl)hydrazinylidene]-3-oxo-N-phenylnaphthalene-2-carboxamide
SYSTEMATIC NAME: (4Z)-4-[(5-chloranyl-2-oxidanyl-phenyl)hydrazinylidene]-3-oxidanylidene-N-phenyl-naphthalene-2-carboxamide
MOLECULAR FORMULA: C23H16ClN3O3
MOLECULAR WEIGHT: 417.84444
SMILES: C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)O)/C2=O
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Product OPENEYE NAME: 3-[benzyl(ethyl)amino]benzenesulfonic acid
CAS Name: 3-[ethyl-(phenylmethyl)amino]benzenesulfonic acid
IUPAC NAME: 3-[benzyl(ethyl)amino]benzenesulfonic acid
SYSTEMATIC NAME: 3-[ethyl-(phenylmethyl)amino]benzenesulfonic acid
MOLECULAR FORMULA: C15H17NO3S
MOLECULAR WEIGHT: 291.36538
SMILES: CCN(CC1=CC=CC=C1)C2=CC(=CC=C2)S(=O)(=O)O
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Product OPENEYE NAME: N-(4-methoxyphenyl)-4-[4-(N-(4-methoxyphenyl)anilino)phenyl]-N-phenyl-aniline
CAS Name: N-(4-methoxyphenyl)-4-[4-(N-(4-methoxyphenyl)anilino)phenyl]-N-phenylaniline
IUPAC NAME: N-(4-methoxyphenyl)-4-[4-(N-(4-methoxyphenyl)anilino)phenyl]-N-phenylaniline
SYSTEMATIC NAME: N-(4-methoxyphenyl)-4-[4-[(4-methoxyphenyl)-phenyl-amino]phenyl]-N-phenyl-aniline
MOLECULAR FORMULA: C38H32N2O2
MOLECULAR WEIGHT: 548.67288
SMILES: COC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=C(C=C6)OC
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Product OPENEYE NAME: 2-(6-methylheptyl)butanedioic acid
CAS Name: 2-(6-methylheptyl)butanedioic acid
IUPAC NAME: 2-(6-methylheptyl)butanedioic acid
SYSTEMATIC NAME: 2-(6-methylheptyl)butanedioic acid
MOLECULAR FORMULA: C12H22O4
MOLECULAR WEIGHT: 230.30068
SMILES: CC(C)CCCCCC(CC(=O)O)C(=O)O
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Product OPENEYE NAME: 3-(3-oxopropoxy)propanal
CAS Name: 3-(3-oxopropoxy)propanal
IUPAC NAME: 3-(3-oxopropoxy)propanal
SYSTEMATIC NAME: 3-(3-oxidanylidenepropoxy)propanal
MOLECULAR FORMULA: C6H10O3
MOLECULAR WEIGHT: 130.1418
SMILES: C(COCCC=O)C=O
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Product OPENEYE NAME: (4-cyano-3-fluoro-phenyl) 4-ethylbenzoate
CAS Name: 4-ethylbenzoic acid (4-cyano-3-fluorophenyl) ester
IUPAC NAME: (4-cyano-3-fluorophenyl) 4-ethylbenzoate
SYSTEMATIC NAME: (4-cyano-3-fluoranyl-phenyl) 4-ethylbenzoate
MOLECULAR FORMULA: C16H12FNO2
MOLECULAR WEIGHT: 269.270383
SMILES: CCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F
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Product OPENEYE NAME: (4-cyanophenyl) 4-(4-ethylcyclohexyl)benzoate
CAS Name: 4-(4-ethylcyclohexyl)benzoic acid (4-cyanophenyl) ester
IUPAC NAME: (4-cyanophenyl) 4-(4-ethylcyclohexyl)benzoate
SYSTEMATIC NAME: (4-cyanophenyl) 4-(4-ethylcyclohexyl)benzoate
MOLECULAR FORMULA: C22H23NO2
MOLECULAR WEIGHT: 333.42352
SMILES: CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N
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Product OPENEYE NAME: (4-cyano-3-fluoro-phenyl) 4-(4-ethylcyclohexyl)benzoate
CAS Name: 4-(4-ethylcyclohexyl)benzoic acid (4-cyano-3-fluorophenyl) ester
IUPAC NAME: (4-cyano-3-fluorophenyl) 4-(4-ethylcyclohexyl)benzoate
SYSTEMATIC NAME: (4-cyano-3-fluoranyl-phenyl) 4-(4-ethylcyclohexyl)benzoate
MOLECULAR FORMULA: C22H22FNO2
MOLECULAR WEIGHT: 351.413983
SMILES: CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F
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Product OPENEYE NAME: (4-cyano-3-fluoro-phenyl) 4-(4-butylcyclohexyl)benzoate
CAS Name: 4-(4-butylcyclohexyl)benzoic acid (4-cyano-3-fluorophenyl) ester
IUPAC NAME: (4-cyano-3-fluorophenyl) 4-(4-butylcyclohexyl)benzoate
SYSTEMATIC NAME: (4-cyano-3-fluoranyl-phenyl) 4-(4-butylcyclohexyl)benzoate
MOLECULAR FORMULA: C24H26FNO2
MOLECULAR WEIGHT: 379.467143
SMILES: CCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F
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Product OPENEYE NAME: 1-propyl-4-(4-propylcyclohexyl)benzene
CAS Name: 1-propyl-4-(4-propylcyclohexyl)benzene
IUPAC NAME: 1-propyl-4-(4-propylcyclohexyl)benzene
SYSTEMATIC NAME: 1-propyl-4-(4-propylcyclohexyl)benzene
MOLECULAR FORMULA: C18H28
MOLECULAR WEIGHT: 244.41492
SMILES: CCCC1CCC(CC1)C2=CC=C(C=C2)CCC
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