Product OPENEYE NAME: 4-cyclopentylphenol
CAS Name: 4-cyclopentylphenol
IUPAC NAME: 4-cyclopentylphenol
SYSTEMATIC NAME: 4-cyclopentylphenol
MOLECULAR FORMULA: C11H14O
MOLECULAR WEIGHT: 162.22826
SMILES: C1CCC(C1)C2=CC=C(C=C2)O
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Product OPENEYE NAME: (1-methyl-3-phenyl-propyl)benzene
CAS Name: 4-phenylbutan-2-ylbenzene
IUPAC NAME: 4-phenylbutan-2-ylbenzene
SYSTEMATIC NAME: 4-phenylbutan-2-ylbenzene
MOLECULAR FORMULA: C16H18
MOLECULAR WEIGHT: 210.31412
SMILES: CC(CCC1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: 2,3-dimethoxybenzoic acid
CAS Name: 2,3-dimethoxybenzoic acid
IUPAC NAME: 2,3-dimethoxybenzoic acid
SYSTEMATIC NAME: 2,3-dimethoxybenzoic acid
MOLECULAR FORMULA: C9H10O4
MOLECULAR WEIGHT: 182.1733
SMILES: COC1=CC=CC(=C1OC)C(=O)O
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Product OPENEYE NAME: 4-(diethylamino)-4-oxo-butanoic acid
CAS Name: 4-(diethylamino)-4-oxobutanoic acid
IUPAC NAME: 4-(diethylamino)-4-oxobutanoic acid
SYSTEMATIC NAME: 4-(diethylamino)-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C8H15NO3
MOLECULAR WEIGHT: 173.2096
SMILES: CCN(CC)C(=O)CCC(=O)O
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Product OPENEYE NAME: 3-bromo-2,2-bis(bromomethyl)propan-1-ol
CAS Name: 3-bromo-2,2-bis(bromomethyl)-1-propanol
IUPAC NAME: 3-bromo-2,2-bis(bromomethyl)propan-1-ol
SYSTEMATIC NAME: 3-bromanyl-2,2-bis(bromomethyl)propan-1-ol
MOLECULAR FORMULA: C5H9Br3O
MOLECULAR WEIGHT: 324.83636
SMILES: C(C(CBr)(CBr)CBr)O
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Product OPENEYE NAME: (3-nitrophenyl) acetate
CAS Name: acetic acid (3-nitrophenyl) ester
IUPAC NAME: (3-nitrophenyl) acetate
SYSTEMATIC NAME: (3-nitrophenyl) ethanoate
MOLECULAR FORMULA: C8H7NO4
MOLECULAR WEIGHT: 181.14548
SMILES: CC(=O)OC1=CC=CC(=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 3-(2,2,2-trifluoroethoxy)prop-1-ene
CAS Name: 3-(2,2,2-trifluoroethoxy)-1-propene
IUPAC NAME: 3-(2,2,2-trifluoroethoxy)prop-1-ene
SYSTEMATIC NAME: 3-[2,2,2-tris(fluoranyl)ethoxy]prop-1-ene
MOLECULAR FORMULA: C5H7F3O
MOLECULAR WEIGHT: 140.10369
SMILES: C=CCOCC(F)(F)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H33FO6
MOLECULAR WEIGHT: 436.513623
SMILES: C[C@]12CCC(=O)C=C1[C@H](C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3C[C@@H]5[C@]4(OC(O5)(C)C)C(=O)CO)C)O)F
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Product OPENEYE NAME: 2-phenylsulfanylbenzoic acid
CAS Name: 2-(phenylthio)benzoic acid
IUPAC NAME: 2-phenylsulfanylbenzoic acid
SYSTEMATIC NAME: 2-phenylsulfanylbenzoic acid
MOLECULAR FORMULA: C13H10O2S
MOLECULAR WEIGHT: 230.2823
SMILES: C1=CC=C(C=C1)SC2=CC=CC=C2C(=O)O
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Product OPENEYE NAME: 2-(2-phenylsulfanylphenyl)acetic acid
CAS Name: 2-[2-(phenylthio)phenyl]acetic acid
IUPAC NAME: 2-(2-phenylsulfanylphenyl)acetic acid
SYSTEMATIC NAME: 2-(2-phenylsulfanylphenyl)ethanoic acid
MOLECULAR FORMULA: C14H12O2S
MOLECULAR WEIGHT: 244.30888
SMILES: C1=CC=C(C=C1)SC2=CC=CC=C2CC(=O)O
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Product OPENEYE NAME: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-yloxy)-N,N-dimethyl-ethanamine
CAS Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-yloxy)-N,N-dimethylethanamine
IUPAC NAME: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-yloxy)-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-yloxy)-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C18H21NOS
MOLECULAR WEIGHT: 299.43044
SMILES: CN(C)CCOC1CC2=CC=CC=C2SC3=CC=CC=C13
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