Product OPENEYE NAME: 3-(trifluoromethyl)phenol
CAS Name: 3-(trifluoromethyl)phenol
IUPAC NAME: 3-(trifluoromethyl)phenol
SYSTEMATIC NAME: 3-(trifluoromethyl)phenol
MOLECULAR FORMULA: C7H5F3O
MOLECULAR WEIGHT: 162.10921
SMILES: C1=CC(=CC(=C1)O)C(F)(F)F
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Product OPENEYE NAME: 3-aminobenzenesulfonamide
CAS Name: 3-aminobenzenesulfonamide
IUPAC NAME: 3-aminobenzenesulfonamide
SYSTEMATIC NAME: 3-azanylbenzenesulfonamide
MOLECULAR FORMULA: C6H8N2O2S
MOLECULAR WEIGHT: 172.20492
SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)N
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Product OPENEYE NAME: 1-tert-butyl-3,5-dimethyl-benzene
CAS Name: 1-tert-butyl-3,5-dimethylbenzene
IUPAC NAME: 1-tert-butyl-3,5-dimethylbenzene
SYSTEMATIC NAME: 1-tert-butyl-3,5-dimethyl-benzene
MOLECULAR FORMULA: C12H18
MOLECULAR WEIGHT: 162.27132
SMILES: CC1=CC(=CC(=C1)C(C)(C)C)C
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Product OPENEYE NAME: 4-tert-butyl-2-methyl-phenol
CAS Name: 4-tert-butyl-2-methylphenol
IUPAC NAME: 4-tert-butyl-2-methylphenol
SYSTEMATIC NAME: 4-tert-butyl-2-methyl-phenol
MOLECULAR FORMULA: C11H16O
MOLECULAR WEIGHT: 164.24414
SMILES: CC1=C(C=CC(=C1)C(C)(C)C)O
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Product OPENEYE NAME: 4-tert-butyl-2-chloro-phenol
CAS Name: 4-tert-butyl-2-chlorophenol
IUPAC NAME: 4-tert-butyl-2-chlorophenol
SYSTEMATIC NAME: 4-tert-butyl-2-chloranyl-phenol
MOLECULAR FORMULA: C10H13ClO
MOLECULAR WEIGHT: 184.66262
SMILES: CC(C)(C)C1=CC(=C(C=C1)O)Cl
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Product OPENEYE NAME: 4-tert-butylbenzene-1,2-diol
CAS Name: 4-tert-butylbenzene-1,2-diol
IUPAC NAME: 4-tert-butylbenzene-1,2-diol
SYSTEMATIC NAME: 4-tert-butylbenzene-1,2-diol
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC(C)(C)C1=CC(=C(C=C1)O)O
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Product OPENEYE NAME: 2-amino-4-methylsulfonyl-phenol
CAS Name: 2-amino-4-methylsulfonylphenol
IUPAC NAME: 2-amino-4-methylsulfonylphenol
SYSTEMATIC NAME: 2-azanyl-4-methylsulfonyl-phenol
MOLECULAR FORMULA: C7H9NO3S
MOLECULAR WEIGHT: 187.21626
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)O)N
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Product OPENEYE NAME: 3,4-dichlorobenzenesulfonyl chloride
CAS Name: 3,4-dichlorobenzenesulfonyl chloride
IUPAC NAME: 3,4-dichlorobenzenesulfonyl chloride
SYSTEMATIC NAME: 3,4-bis(chloranyl)benzenesulfonyl chloride
MOLECULAR FORMULA: C6H3Cl3O2S
MOLECULAR WEIGHT: 245.51082
SMILES: C1=CC(=C(C=C1S(=O)(=O)Cl)Cl)Cl
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Product OPENEYE NAME: 4-amino-3-methyl-benzenesulfonic acid
CAS Name: 4-amino-3-methylbenzenesulfonic acid
IUPAC NAME: 4-amino-3-methylbenzenesulfonic acid
SYSTEMATIC NAME: 4-azanyl-3-methyl-benzenesulfonic acid
MOLECULAR FORMULA: C7H9NO3S
MOLECULAR WEIGHT: 187.21626
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)O)N
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Product OPENEYE NAME: 3-amino-4-hydroxy-benzenesulfonic acid
CAS Name: 3-amino-4-hydroxybenzenesulfonic acid
IUPAC NAME: 3-amino-4-hydroxybenzenesulfonic acid
SYSTEMATIC NAME: 3-azanyl-4-oxidanyl-benzenesulfonic acid
MOLECULAR FORMULA: C6H7NO4S
MOLECULAR WEIGHT: 189.18908
SMILES: C1=CC(=C(C=C1S(=O)(=O)O)N)O
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Product OPENEYE NAME: 1-nitro-3-(trifluoromethyl)benzene
CAS Name: 1-nitro-3-(trifluoromethyl)benzene
IUPAC NAME: 1-nitro-3-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-nitro-3-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7H4F3NO2
MOLECULAR WEIGHT: 191.10737
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F
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Product OPENEYE NAME: 3-nitrobenzenesulfonic acid
CAS Name: 3-nitrobenzenesulfonic acid
IUPAC NAME: 3-nitrobenzenesulfonic acid
SYSTEMATIC NAME: 3-nitrobenzenesulfonic acid
MOLECULAR FORMULA: C6H5NO5S
MOLECULAR WEIGHT: 203.1726
SMILES: C1=CC(=CC(=C1)S(=O)(=O)O)[N+](=O)[O-]
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Product OPENEYE NAME: benzene-1,3-disulfonic acid
CAS Name: benzene-1,3-disulfonic acid
IUPAC NAME: benzene-1,3-disulfonic acid
SYSTEMATIC NAME: benzene-1,3-disulfonic acid
MOLECULAR FORMULA: C6H6O6S2
MOLECULAR WEIGHT: 238.23824
SMILES: C1=CC(=CC(=C1)S(=O)(=O)O)S(=O)(=O)O
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Product OPENEYE NAME: (4-aminophenyl)arsonic acid
CAS Name: (4-aminophenyl)arsonic acid
IUPAC NAME: (4-aminophenyl)arsonic acid
SYSTEMATIC NAME: (4-aminophenyl)arsonic acid
MOLECULAR FORMULA: C6H8AsNO3
MOLECULAR WEIGHT: 217.05422
SMILES: C1=CC(=CC=C1N)[As](=O)(O)O
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Product OPENEYE NAME: 1-tert-butyl-4-methyl-benzene
CAS Name: 1-tert-butyl-4-methylbenzene
IUPAC NAME: 1-tert-butyl-4-methylbenzene
SYSTEMATIC NAME: 1-tert-butyl-4-methyl-benzene
MOLECULAR FORMULA: C11H16
MOLECULAR WEIGHT: 148.24474
SMILES: CC1=CC=C(C=C1)C(C)(C)C
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Product OPENEYE NAME: 4-tert-butylcyclohexanol
CAS Name: 4-tert-butyl-1-cyclohexanol
IUPAC NAME: 4-tert-butylcyclohexan-1-ol
SYSTEMATIC NAME: 4-tert-butylcyclohexan-1-ol
MOLECULAR FORMULA: C10H20O
MOLECULAR WEIGHT: 156.2652
SMILES: CC(C)(C)C1CCC(CC1)O
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Product OPENEYE NAME: 4-tert-butylcyclohexanone
CAS Name: 4-tert-butyl-1-cyclohexanone
IUPAC NAME: 4-tert-butylcyclohexan-1-one
SYSTEMATIC NAME: 4-tert-butylcyclohexan-1-one
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(C)(C)C1CCC(=O)CC1
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Product OPENEYE NAME: 4-tert-butylphenol
CAS Name: 4-tert-butylphenol
IUPAC NAME: 4-tert-butylphenol
SYSTEMATIC NAME: 4-tert-butylphenol
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC(C)(C)C1=CC=C(C=C1)O
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Product OPENEYE NAME: 1-chloro-4-(trifluoromethyl)benzene
CAS Name: 1-chloro-4-(trifluoromethyl)benzene
IUPAC NAME: 1-chloro-4-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-chloranyl-4-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7H4ClF3
MOLECULAR WEIGHT: 180.55487
SMILES: C1=CC(=CC=C1C(F)(F)F)Cl
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Product OPENEYE NAME: 1-chloro-4-methylsulfonyl-benzene
CAS Name: 1-chloro-4-methylsulfonylbenzene
IUPAC NAME: 1-chloro-4-methylsulfonylbenzene
SYSTEMATIC NAME: 1-chloranyl-4-methylsulfonyl-benzene
MOLECULAR FORMULA: C7H7ClO2S
MOLECULAR WEIGHT: 190.64728
SMILES: CS(=O)(=O)C1=CC=C(C=C1)Cl
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Product OPENEYE NAME: 4-bromobenzenesulfonyl chloride
CAS Name: 4-bromobenzenesulfonyl chloride
IUPAC NAME: 4-bromobenzenesulfonyl chloride
SYSTEMATIC NAME: 4-bromanylbenzenesulfonyl chloride
MOLECULAR FORMULA: C6H4BrClO2S
MOLECULAR WEIGHT: 255.51676
SMILES: C1=CC(=CC=C1S(=O)(=O)Cl)Br
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Product OPENEYE NAME: 4-methylbenzenesulfonyl chloride
CAS Name: 4-methylbenzenesulfonyl chloride
IUPAC NAME: 4-methylbenzenesulfonyl chloride
SYSTEMATIC NAME: 4-methylbenzenesulfonyl chloride
MOLECULAR FORMULA: C7H7ClO2S
MOLECULAR WEIGHT: 190.64728
SMILES: CC1=CC=C(C=C1)S(=O)(=O)Cl
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