Product OPENEYE NAME: 2-(p-tolyl)propan-2-ol
CAS Name: 2-(4-methylphenyl)-2-propanol
IUPAC NAME: 2-(4-methylphenyl)propan-2-ol
SYSTEMATIC NAME: 2-(4-methylphenyl)propan-2-ol
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC1=CC=C(C=C1)C(C)(C)O
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Product OPENEYE NAME: 1-(3,4-dihydroxyphenyl)ethanone
CAS Name: 1-(3,4-dihydroxyphenyl)ethanone
IUPAC NAME: 1-(3,4-dihydroxyphenyl)ethanone
SYSTEMATIC NAME: 1-[3,4-bis(oxidanyl)phenyl]ethanone
MOLECULAR FORMULA: C8H8O3
MOLECULAR WEIGHT: 152.14732
SMILES: CC(=O)C1=CC(=C(C=C1)O)O
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Product OPENEYE NAME: 4-arsorosobenzoic acid
CAS Name: 4-arsorosobenzoic acid
IUPAC NAME: 4-arsorosobenzoic acid
SYSTEMATIC NAME: 4-arsorosobenzoic acid
MOLECULAR FORMULA: C7H5AsO3
MOLECULAR WEIGHT: 212.0344
SMILES: C1=CC(=CC=C1C(=O)O)[As]=O
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Product OPENEYE NAME: 4-ethoxybenzene-1,2-diamine
CAS Name: 4-ethoxybenzene-1,2-diamine
IUPAC NAME: 4-ethoxybenzene-1,2-diamine
SYSTEMATIC NAME: 4-ethoxybenzene-1,2-diamine
MOLECULAR FORMULA: C8H12N2O
MOLECULAR WEIGHT: 152.19368
SMILES: CCOC1=CC(=C(C=C1)N)N
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Product OPENEYE NAME: 2-(4-aminophenyl)acetic acid
CAS Name: 2-(4-aminophenyl)acetic acid
IUPAC NAME: 2-(4-aminophenyl)acetic acid
SYSTEMATIC NAME: 2-(4-aminophenyl)ethanoic acid
MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: C1=CC(=CC=C1CC(=O)O)N
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Product OPENEYE NAME: (2-hydroxy-1-naphthyl)ammonium chloride
CAS Name: (2-hydroxy-1-naphthalenyl)ammonium chloride
IUPAC NAME: (2-hydroxynaphthalen-1-yl)azanium chloride
SYSTEMATIC NAME: (2-oxidanylnaphthalen-1-yl)azanium chloride
MOLECULAR FORMULA: C10H10ClNO
MOLECULAR WEIGHT: 195.6455
SMILES: C1=CC=C2C(=C1)C=CC(=C2[NH3+])O.[Cl-]
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Product OPENEYE NAME: 1-aminonaphthalen-2-ol
CAS Name: 1-amino-2-naphthalenol
IUPAC NAME: 1-aminonaphthalen-2-ol
SYSTEMATIC NAME: 1-azanylnaphthalen-2-ol
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: C1=CC=C2C(=C1)C=CC(=C2N)O
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Product OPENEYE NAME: 2,4-dimethylquinoline
CAS Name: 2,4-dimethylquinoline
IUPAC NAME: 2,4-dimethylquinoline
SYSTEMATIC NAME: 2,4-dimethylquinoline
MOLECULAR FORMULA: C11H11N
MOLECULAR WEIGHT: 157.21174
SMILES: CC1=CC(=NC2=CC=CC=C12)C
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Product OPENEYE NAME: 3,4,5,6-tetrachlorobenzene-1,2-diol
CAS Name: 3,4,5,6-tetrachlorobenzene-1,2-diol
IUPAC NAME: 3,4,5,6-tetrachlorobenzene-1,2-diol
SYSTEMATIC NAME: 3,4,5,6-tetrakis(chloranyl)benzene-1,2-diol
MOLECULAR FORMULA: C6H2Cl4O2
MOLECULAR WEIGHT: 247.89088
SMILES: C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)O)O
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Product OPENEYE NAME: 2-phenyl-2H-1,3,4-oxadiazol-5-one
CAS Name: 2-phenyl-2H-1,3,4-oxadiazol-5-one
IUPAC NAME: 2-phenyl-2H-1,3,4-oxadiazol-5-one
SYSTEMATIC NAME: 2-phenyl-2H-1,3,4-oxadiazol-5-one
MOLECULAR FORMULA: C8H6N2O2
MOLECULAR WEIGHT: 162.14544
SMILES: C1=CC=C(C=C1)C2N=NC(=O)O2
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Product OPENEYE NAME: 2-(3-azabicyclo[3.2.2]nonan-3-yl)acetonitrile
CAS Name: 2-(3-azabicyclo[3.2.2]nonan-3-yl)acetonitrile
IUPAC NAME: 2-(3-azabicyclo[3.2.2]nonan-3-yl)acetonitrile
SYSTEMATIC NAME: 2-(3-azabicyclo[3.2.2]nonan-3-yl)ethanenitrile
MOLECULAR FORMULA: C10H16N2
MOLECULAR WEIGHT: 164.24744
SMILES: C1CC2CCC1CN(C2)CC#N
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Product OPENEYE NAME: 2-methyl-3-phenyl-prop-2-enoic acid
CAS Name: 2-methyl-3-phenyl-2-propenoic acid
IUPAC NAME: 2-methyl-3-phenylprop-2-enoic acid
SYSTEMATIC NAME: 2-methyl-3-phenyl-prop-2-enoic acid
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: CC(=CC1=CC=CC=C1)C(=O)O
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Product OPENEYE NAME: 4-(3-methylbut-2-enyl)phenol
CAS Name: 4-(3-methylbut-2-enyl)phenol
IUPAC NAME: 4-(3-methylbut-2-enyl)phenol
SYSTEMATIC NAME: 4-(3-methylbut-2-enyl)phenol
MOLECULAR FORMULA: C11H14O
MOLECULAR WEIGHT: 162.22826
SMILES: CC(=CCC1=CC=C(C=C1)O)C
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Product OPENEYE NAME: bis(2-fluoroethyl)-phenyl-ammonium chloride
CAS Name: bis(2-fluoroethyl)-phenylammonium chloride
IUPAC NAME: bis(2-fluoroethyl)-phenylazanium chloride
SYSTEMATIC NAME: bis(2-fluoranylethyl)-phenyl-azanium chloride
MOLECULAR FORMULA: C10H14ClF2N
MOLECULAR WEIGHT: 221.674666
SMILES: C1=CC=C(C=C1)[NH+](CCF)CCF.[Cl-]
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Product OPENEYE NAME: N,N-bis(2-fluoroethyl)aniline
CAS Name: N,N-bis(2-fluoroethyl)aniline
IUPAC NAME: N,N-bis(2-fluoroethyl)aniline
SYSTEMATIC NAME: N,N-bis(2-fluoranylethyl)aniline
MOLECULAR FORMULA: C10H13F2N
MOLECULAR WEIGHT: 185.213726
SMILES: C1=CC=C(C=C1)N(CCF)CCF
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Product OPENEYE NAME: 3-(2,4-dichlorophenyl)prop-2-enoic acid
CAS Name: 3-(2,4-dichlorophenyl)-2-propenoic acid
IUPAC NAME: 3-(2,4-dichlorophenyl)prop-2-enoic acid
SYSTEMATIC NAME: 3-(2,4-dichlorophenyl)prop-2-enoic acid
MOLECULAR FORMULA: C9H6Cl2O2
MOLECULAR WEIGHT: 217.04874
SMILES: C1=CC(=C(C=C1Cl)Cl)C=CC(=O)O
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Product OPENEYE NAME: N-(2-pyridyl)pyridin-2-amine
CAS Name: N-(2-pyridinyl)-2-pyridinamine
IUPAC NAME: N-pyridin-2-ylpyridin-2-amine
SYSTEMATIC NAME: N-pyridin-2-ylpyridin-2-amine
MOLECULAR FORMULA: C10H9N3
MOLECULAR WEIGHT: 171.19856
SMILES: C1=CC=NC(=C1)NC2=CC=CC=N2
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Product OPENEYE NAME: 3-(3,4-dichlorophenyl)prop-2-enoic acid
CAS Name: 3-(3,4-dichlorophenyl)-2-propenoic acid
IUPAC NAME: 3-(3,4-dichlorophenyl)prop-2-enoic acid
SYSTEMATIC NAME: 3-(3,4-dichlorophenyl)prop-2-enoic acid
MOLECULAR FORMULA: C9H6Cl2O2
MOLECULAR WEIGHT: 217.04874
SMILES: C1=CC(=C(C=C1C=CC(=O)O)Cl)Cl
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Product OPENEYE NAME: 1,1,2,3,3-pentamethylindane
CAS Name: 1,1,2,3,3-pentamethyl-2H-indene
IUPAC NAME: 1,1,2,3,3-pentamethyl-2H-indene
SYSTEMATIC NAME: 1,1,2,3,3-pentamethyl-2H-indene
MOLECULAR FORMULA: C14H20
MOLECULAR WEIGHT: 188.3086
SMILES: CC1C(C2=CC=CC=C2C1(C)C)(C)C
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Product OPENEYE NAME: 1-(2-chlorophenyl)pyrrole-2,5-dione
CAS Name: 1-(2-chlorophenyl)pyrrole-2,5-dione
IUPAC NAME: 1-(2-chlorophenyl)pyrrole-2,5-dione
SYSTEMATIC NAME: 1-(2-chlorophenyl)pyrrole-2,5-dione
MOLECULAR FORMULA: C10H6ClNO2
MOLECULAR WEIGHT: 207.61314
SMILES: C1=CC=C(C(=C1)N2C(=O)C=CC2=O)Cl
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Product OPENEYE NAME: [2-(4-chloro-1H-indol-3-yl)-1-methyl-ethyl]ammonium chloride
CAS Name: 1-(4-chloro-1H-indol-3-yl)propan-2-ylammonium chloride
IUPAC NAME: 1-(4-chloro-1H-indol-3-yl)propan-2-ylazanium chloride
SYSTEMATIC NAME: 1-(4-chloranyl-1H-indol-3-yl)propan-2-ylazanium chloride
MOLECULAR FORMULA: C11H14Cl2N2
MOLECULAR WEIGHT: 245.14826
SMILES: CC(CC1=CNC2=C1C(=CC=C2)Cl)[NH3+].[Cl-]
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H12Br2N2
MOLECULAR WEIGHT: 344.04508
SMILES: C1=CC2=C3C=CC=C[NH+]3C=C[NH+]2C=C1.[Br-].[Br-]
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H10N2
MOLECULAR WEIGHT: 182.2212
SMILES: C1=CC2=C3C=CC=CN3C=CN2C=C1
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Product OPENEYE NAME: 2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone
CAS Name: 2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone
IUPAC NAME: 2,2-dichloro-1-(2,4,5-trichlorophenyl)ethanone
SYSTEMATIC NAME: 2,2-bis(chloranyl)-1-[2,4,5-tris(chloranyl)phenyl]ethanone
MOLECULAR FORMULA: C8H3Cl5O
MOLECULAR WEIGHT: 292.37382
SMILES: C1=C(C(=CC(=C1Cl)Cl)Cl)C(=O)C(Cl)Cl
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