Product OPENEYE NAME: 1-bromo-4-nitro-benzene
CAS Name: 1-bromo-4-nitrobenzene
IUPAC NAME: 1-bromo-4-nitrobenzene
SYSTEMATIC NAME: 1-bromanyl-4-nitro-benzene
MOLECULAR FORMULA: C6H4BrNO2
MOLECULAR WEIGHT: 202.00546
SMILES: C1=CC(=CC=C1[N+](=O)[O-])Br
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Product OPENEYE NAME: 4-isopropylidene-1-methyl-cyclohexanol
CAS Name: 1-methyl-4-propan-2-ylidene-1-cyclohexanol
IUPAC NAME: 1-methyl-4-propan-2-ylidenecyclohexan-1-ol
SYSTEMATIC NAME: 1-methyl-4-propan-2-ylidene-cyclohexan-1-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(=C1CCC(CC1)(C)O)C
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Product OPENEYE NAME: 4-isopropyl-1-methyl-cyclohex-3-en-1-ol
CAS Name: 1-methyl-4-propan-2-yl-1-cyclohex-3-enol
IUPAC NAME: 1-methyl-4-propan-2-ylcyclohex-3-en-1-ol
SYSTEMATIC NAME: 1-methyl-4-propan-2-yl-cyclohex-3-en-1-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(C)C1=CCC(CC1)(C)O
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Product OPENEYE NAME: 2-(methoxymethyl)-5-nitro-furan
CAS Name: 2-(methoxymethyl)-5-nitrofuran
IUPAC NAME: 2-(methoxymethyl)-5-nitrofuran
SYSTEMATIC NAME: 2-(methoxymethyl)-5-nitro-furan
MOLECULAR FORMULA: C6H7NO4
MOLECULAR WEIGHT: 157.12408
SMILES: COCC1=CC=C(O1)[N+](=O)[O-]
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Product OPENEYE NAME: 4-acetylbenzoic acid
CAS Name: 4-acetylbenzoic acid
IUPAC NAME: 4-acetylbenzoic acid
SYSTEMATIC NAME: 4-ethanoylbenzoic acid
MOLECULAR FORMULA: C9H8O3
MOLECULAR WEIGHT: 164.15802
SMILES: CC(=O)C1=CC=C(C=C1)C(=O)O
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Product OPENEYE NAME: 4-(4-carboxyphenyl)azobenzoic acid
CAS Name: 4-(4-carboxyphenyl)azobenzoic acid
IUPAC NAME: 4-[(4-carboxyphenyl)diazenyl]benzoic acid
SYSTEMATIC NAME: 4-[(4-carboxyphenyl)diazenyl]benzoic acid
MOLECULAR FORMULA: C14H10N2O4
MOLECULAR WEIGHT: 270.2402
SMILES: C1=CC(=CC=C1C(=O)O)N=NC2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-pyridylmethanol
CAS Name: pyridin-4-ylmethanol
IUPAC NAME: pyridin-4-ylmethanol
SYSTEMATIC NAME: pyridin-4-ylmethanol
MOLECULAR FORMULA: C6H7NO
MOLECULAR WEIGHT: 109.12588
SMILES: C1=CN=CC=C1CO
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Product OPENEYE NAME: nitrosobenzene
CAS Name: nitrosobenzene
IUPAC NAME: nitrosobenzene
SYSTEMATIC NAME: nitrosobenzene
MOLECULAR FORMULA: C6H5NO
MOLECULAR WEIGHT: 107.11
SMILES: C1=CC=C(C=C1)N=O
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Product OPENEYE NAME: 2-pyridylmethanol
CAS Name: 2-pyridinylmethanol
IUPAC NAME: pyridin-2-ylmethanol
SYSTEMATIC NAME: pyridin-2-ylmethanol
MOLECULAR FORMULA: C6H7NO
MOLECULAR WEIGHT: 109.12588
SMILES: C1=CC=NC(=C1)CO
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Product OPENEYE NAME: 3-ethylaniline
CAS Name: 3-ethylaniline
IUPAC NAME: 3-ethylaniline
SYSTEMATIC NAME: 3-ethylaniline
MOLECULAR FORMULA: C8H11N
MOLECULAR WEIGHT: 121.17964
SMILES: CCC1=CC(=CC=C1)N
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Product OPENEYE NAME: m-tolylmethanol
CAS Name: (3-methylphenyl)methanol
IUPAC NAME: (3-methylphenyl)methanol
SYSTEMATIC NAME: (3-methylphenyl)methanol
MOLECULAR FORMULA: C8H10O
MOLECULAR WEIGHT: 122.1644
SMILES: CC1=CC(=CC=C1)CO
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Product OPENEYE NAME: 3-chlorobenzaldehyde
CAS Name: 3-chlorobenzaldehyde
IUPAC NAME: 3-chlorobenzaldehyde
SYSTEMATIC NAME: 3-chloranylbenzaldehyde
MOLECULAR FORMULA: C7H5ClO
MOLECULAR WEIGHT: 140.567
SMILES: C1=CC(=CC(=C1)Cl)C=O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H20N4O3
MOLECULAR WEIGHT: 292.3336
SMILES: C1N2CN3CN1CN(C2)C3.C1=CC=C(C=C1)C(C(=O)O)O
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Product OPENEYE NAME: (3R)-2-amino-3-hydroxy-3-phenyl-propanoic acid
CAS Name: (3R)-2-amino-3-hydroxy-3-phenylpropanoic acid
IUPAC NAME: (3R)-2-amino-3-hydroxy-3-phenylpropanoic acid
SYSTEMATIC NAME: (3R)-2-azanyl-3-oxidanyl-3-phenyl-propanoic acid
MOLECULAR FORMULA: C9H11NO3
MOLECULAR WEIGHT: 181.18854
SMILES: C1=CC=C(C=C1)[C@H](C(C(=O)O)N)O
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