Product OPENEYE NAME: 2-ethoxybenzaldehyde
CAS Name: 2-ethoxybenzaldehyde
IUPAC NAME: 2-ethoxybenzaldehyde
SYSTEMATIC NAME: 2-ethoxybenzaldehyde
MOLECULAR FORMULA: C9H10O2
MOLECULAR WEIGHT: 150.1745
SMILES: CCOC1=CC=CC=C1C=O
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Product OPENEYE NAME: naphthalene-2,7-diamine
CAS Name: naphthalene-2,7-diamine
IUPAC NAME: naphthalene-2,7-diamine
SYSTEMATIC NAME: naphthalene-2,7-diamine
MOLECULAR FORMULA: C10H10N2
MOLECULAR WEIGHT: 158.1998
SMILES: C1=CC(=CC2=C1C=CC(=C2)N)N
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Product OPENEYE NAME: 2-amino-1-phenyl-ethanone
CAS Name: 2-amino-1-phenylethanone
IUPAC NAME: 2-amino-1-phenylethanone
SYSTEMATIC NAME: 2-azanyl-1-phenyl-ethanone
MOLECULAR FORMULA: C8H9NO
MOLECULAR WEIGHT: 135.16316
SMILES: C1=CC=C(C=C1)C(=O)CN
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Product OPENEYE NAME: benzoyl cyanide
CAS Name: 2-oxo-2-phenylacetonitrile
IUPAC NAME: benzoyl cyanide
SYSTEMATIC NAME: 2-oxidanylidene-2-phenyl-ethanenitrile
MOLECULAR FORMULA: C8H5NO
MOLECULAR WEIGHT: 131.1314
SMILES: C1=CC=C(C=C1)C(=O)C#N
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Product OPENEYE NAME: N-methylbenzamide
CAS Name: N-methylbenzamide
IUPAC NAME: N-methylbenzamide
SYSTEMATIC NAME: N-methylbenzamide
MOLECULAR FORMULA: C8H9NO
MOLECULAR WEIGHT: 135.16316
SMILES: CNC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: benzohydrazide
CAS Name: benzohydrazide
IUPAC NAME: benzohydrazide
SYSTEMATIC NAME: benzohydrazide
MOLECULAR FORMULA: C7H8N2O
MOLECULAR WEIGHT: 136.15122
SMILES: C1=CC=C(C=C1)C(=O)NN
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Product OPENEYE NAME: N-ethyl-N-methyl-aniline
CAS Name: N-ethyl-N-methylaniline
IUPAC NAME: N-ethyl-N-methylaniline
SYSTEMATIC NAME: N-ethyl-N-methyl-aniline
MOLECULAR FORMULA: C9H13N
MOLECULAR WEIGHT: 135.20622
SMILES: CCN(C)C1=CC=CC=C1
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Product OPENEYE NAME: N-methyl-N-phenyl-nitrous amide
CAS Name: N-methyl-N-phenylnitrous amide
IUPAC NAME: N-methyl-N-phenylnitrous amide
SYSTEMATIC NAME: N-methyl-N-phenyl-nitrous amide
MOLECULAR FORMULA: C7H8N2O
MOLECULAR WEIGHT: 136.15122
SMILES: CN(C1=CC=CC=C1)N=O
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Product OPENEYE NAME: 2-methoxy-5-methyl-1,4-benzoquinone
CAS Name: 2-methoxy-5-methylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2-methoxy-5-methylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2-methoxy-5-methyl-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C8H8O3
MOLECULAR WEIGHT: 152.14732
SMILES: CC1=CC(=O)C(=CC1=O)OC
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Product OPENEYE NAME: N-ethylbenzamide
CAS Name: N-ethylbenzamide
IUPAC NAME: N-ethylbenzamide
SYSTEMATIC NAME: N-ethylbenzamide
MOLECULAR FORMULA: C9H11NO
MOLECULAR WEIGHT: 149.18974
SMILES: CCNC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: (4-chlorophenyl)-(4-chlorophenyl)imino-oxido-ammonium
CAS Name: (4-chlorophenyl)-(4-chlorophenyl)imino-oxidoammonium
IUPAC NAME: (4-chlorophenyl)-(4-chlorophenyl)imino-oxidoazanium
SYSTEMATIC NAME: (4-chlorophenyl)-(4-chlorophenyl)imino-oxidanidyl-azanium
MOLECULAR FORMULA: C12H8Cl2N2O
MOLECULAR WEIGHT: 267.11072
SMILES: C1=CC(=CC=C1N=[N+](C2=CC=C(C=C2)Cl)[O-])Cl
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Product OPENEYE NAME: propanoyl benzoate
CAS Name: benzoic acid 1-oxopropyl ester
IUPAC NAME: propanoyl benzoate
SYSTEMATIC NAME: propanoyl benzoate
MOLECULAR FORMULA: C10H10O3
MOLECULAR WEIGHT: 178.1846
SMILES: CCC(=O)OC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: p-tolyl benzoate
CAS Name: benzoic acid (4-methylphenyl) ester
IUPAC NAME: (4-methylphenyl) benzoate
SYSTEMATIC NAME: (4-methylphenyl) benzoate
MOLECULAR FORMULA: C14H12O2
MOLECULAR WEIGHT: 212.24388
SMILES: CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(4-aminobenzoyl)oxyethyl-pentyl-ammonium chloride
CAS Name: 2-[(4-aminophenyl)-oxomethoxy]ethyl-pentylammonium chloride
IUPAC NAME: 2-(4-aminobenzoyl)oxyethyl-pentylazanium chloride
SYSTEMATIC NAME: 2-(4-aminophenyl)carbonyloxyethyl-pentyl-azanium chloride
MOLECULAR FORMULA: C14H23ClN2O2
MOLECULAR WEIGHT: 286.79762
SMILES: CCCCC[NH2+]CCOC(=O)C1=CC=C(C=C1)N.[Cl-]
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Product OPENEYE NAME: 2-(pentylamino)ethyl 4-aminobenzoate
CAS Name: 4-aminobenzoic acid 2-(pentylamino)ethyl ester
IUPAC NAME: 2-(pentylamino)ethyl 4-aminobenzoate
SYSTEMATIC NAME: 2-(pentylamino)ethyl 4-azanylbenzoate
MOLECULAR FORMULA: C14H22N2O2
MOLECULAR WEIGHT: 250.33668
SMILES: CCCCCNCCOC(=O)C1=CC=C(C=C1)N
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Product OPENEYE NAME: 2-fluoroethyl benzoate
CAS Name: benzoic acid 2-fluoroethyl ester
IUPAC NAME: 2-fluoroethyl benzoate
SYSTEMATIC NAME: 2-fluoranylethyl benzoate
MOLECULAR FORMULA: C9H9FO2
MOLECULAR WEIGHT: 168.164963
SMILES: C1=CC=C(C=C1)C(=O)OCCF
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Product OPENEYE NAME: tert-butyl benzenecarboperoxoate
CAS Name: benzenecarboperoxoic acid tert-butyl ester
IUPAC NAME: tert-butyl benzenecarboperoxoate
SYSTEMATIC NAME: tert-butyl benzenecarboperoxoate
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC(C)(C)OOC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: 3-fluoropropyl benzoate
CAS Name: benzoic acid 3-fluoropropyl ester
IUPAC NAME: 3-fluoropropyl benzoate
SYSTEMATIC NAME: 3-fluoranylpropyl benzoate
MOLECULAR FORMULA: C10H11FO2
MOLECULAR WEIGHT: 182.191543
SMILES: C1=CC=C(C=C1)C(=O)OCCCF
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Product OPENEYE NAME: 3-(2-hydroxyphenyl)prop-2-enoic acid
CAS Name: 3-(2-hydroxyphenyl)-2-propenoic acid
IUPAC NAME: 3-(2-hydroxyphenyl)prop-2-enoic acid
SYSTEMATIC NAME: 3-(2-hydroxyphenyl)prop-2-enoic acid
MOLECULAR FORMULA: C9H8O3
MOLECULAR WEIGHT: 164.15802
SMILES: C1=CC=C(C(=C1)C=CC(=O)O)O
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