Product OPENEYE NAME: 2-(trifluoromethyl)-3H-benzimidazol-5-amine
CAS Name: 2-(trifluoromethyl)-3H-benzimidazol-5-amine
IUPAC NAME: 2-(trifluoromethyl)-3H-benzimidazol-5-amine
SYSTEMATIC NAME: 2-(trifluoromethyl)-3H-benzimidazol-5-amine
MOLECULAR FORMULA: C8H6F3N3
MOLECULAR WEIGHT: 201.14855
SMILES: C1=CC2=C(C=C1N)NC(=N2)C(F)(F)F
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Product OPENEYE NAME: 6-tert-butyl-2-(trifluoromethyl)-1H-benzimidazole
CAS Name: 6-tert-butyl-2-(trifluoromethyl)-1H-benzimidazole
IUPAC NAME: 6-tert-butyl-2-(trifluoromethyl)-1H-benzimidazole
SYSTEMATIC NAME: 6-tert-butyl-2-(trifluoromethyl)-1H-benzimidazole
MOLECULAR FORMULA: C12H13F3N2
MOLECULAR WEIGHT: 242.24023
SMILES: CC(C)(C)C1=CC2=C(C=C1)N=C(N2)C(F)(F)F
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Product OPENEYE NAME: N-(9H-fluoren-2-yl)-N-hydroxy-benzamide
CAS Name: N-(9H-fluoren-2-yl)-N-hydroxybenzamide
IUPAC NAME: N-(9H-fluoren-2-yl)-N-hydroxybenzamide
SYSTEMATIC NAME: N-(9H-fluoren-2-yl)-N-oxidanyl-benzamide
MOLECULAR FORMULA: C20H15NO2
MOLECULAR WEIGHT: 301.3386
SMILES: C1C2=CC=CC=C2C3=C1C=C(C=C3)N(C(=O)C4=CC=CC=C4)O
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Product OPENEYE NAME: [2-(3,4-dichlorophenyl)-2-hydroxy-ethyl]ammonium chloride
CAS Name: [2-(3,4-dichlorophenyl)-2-hydroxyethyl]ammonium chloride
IUPAC NAME: [2-(3,4-dichlorophenyl)-2-hydroxyethyl]azanium chloride
SYSTEMATIC NAME: [2-(3,4-dichlorophenyl)-2-oxidanyl-ethyl]azanium chloride
MOLECULAR FORMULA: C8H10Cl3NO
MOLECULAR WEIGHT: 242.5301
SMILES: C1=CC(=C(C=C1C(C[NH3+])O)Cl)Cl.[Cl-]
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Product OPENEYE NAME: 2-amino-1-(3,4-dichlorophenyl)ethanol
CAS Name: 2-amino-1-(3,4-dichlorophenyl)ethanol
IUPAC NAME: 2-amino-1-(3,4-dichlorophenyl)ethanol
SYSTEMATIC NAME: 2-azanyl-1-(3,4-dichlorophenyl)ethanol
MOLECULAR FORMULA: C8H9Cl2NO
MOLECULAR WEIGHT: 206.06916
SMILES: C1=CC(=C(C=C1C(CN)O)Cl)Cl
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Product OPENEYE NAME: 2,3,5-trimethylphenanthrene
CAS Name: 2,3,5-trimethylphenanthrene
IUPAC NAME: 2,3,5-trimethylphenanthrene
SYSTEMATIC NAME: 2,3,5-trimethylphenanthrene
MOLECULAR FORMULA: C17H16
MOLECULAR WEIGHT: 220.30894
SMILES: CC1=CC=CC2=C1C3=CC(=C(C=C3C=C2)C)C
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Product OPENEYE NAME: 2-ethylphenanthrene
CAS Name: 2-ethylphenanthrene
IUPAC NAME: 2-ethylphenanthrene
SYSTEMATIC NAME: 2-ethylphenanthrene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: CCC1=CC2=C(C=C1)C3=CC=CC=C3C=C2
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Product OPENEYE NAME: 9-ethylphenanthrene
CAS Name: 9-ethylphenanthrene
IUPAC NAME: 9-ethylphenanthrene
SYSTEMATIC NAME: 9-ethylphenanthrene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: CCC1=CC2=CC=CC=C2C3=CC=CC=C31
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Product OPENEYE NAME: 1-methylsulfonylethylene
CAS Name: 1-methylsulfonylethene
IUPAC NAME: 1-methylsulfonylethene
SYSTEMATIC NAME: 1-methylsulfonylethene
MOLECULAR FORMULA: C3H6O2S
MOLECULAR WEIGHT: 106.14354
SMILES: CS(=O)(=O)C=C
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Product OPENEYE NAME: 2-phenylazobenzoic acid
CAS Name: 2-phenyldiazenylbenzoic acid
IUPAC NAME: 2-phenyldiazenylbenzoic acid
SYSTEMATIC NAME: 2-phenyldiazenylbenzoic acid
MOLECULAR FORMULA: C13H10N2O2
MOLECULAR WEIGHT: 226.2307
SMILES: C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O
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Product OPENEYE NAME: 2-anilino-2-phenyl-acetic acid
CAS Name: 2-anilino-2-phenylacetic acid
IUPAC NAME: 2-anilino-2-phenylacetic acid
SYSTEMATIC NAME: 2-phenyl-2-phenylazanyl-ethanoic acid
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: C1=CC=C(C=C1)C(C(=O)O)NC2=CC=CC=C2
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Product OPENEYE NAME: N-(cyanomethyl)-N-methyl-nitrous amide
CAS Name: N-(cyanomethyl)-N-methylnitrous amide
IUPAC NAME: N-(cyanomethyl)-N-methylnitrous amide
SYSTEMATIC NAME: N-(cyanomethyl)-N-methyl-nitrous amide
MOLECULAR FORMULA: C3H5N3O
MOLECULAR WEIGHT: 99.0913
SMILES: CN(CC#N)N=O
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Product OPENEYE NAME: [1-(2-phenylethyl)piperidin-1-ium-4-yl] 2,2-diphenylacetate chloride
CAS Name: 2,2-diphenylacetic acid [1-(2-phenylethyl)-4-piperidin-1-iumyl] ester chloride
IUPAC NAME: [1-(2-phenylethyl)piperidin-1-ium-4-yl] 2,2-diphenylacetate chloride
SYSTEMATIC NAME: [1-(2-phenylethyl)piperidin-1-ium-4-yl] 2,2-diphenylethanoate chloride
MOLECULAR FORMULA: C27H30ClNO2
MOLECULAR WEIGHT: 435.9856
SMILES: C1C[NH+](CCC1OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: [1-(2-phenylethyl)-4-piperidyl] 2,2-diphenylacetate
CAS Name: 2,2-diphenylacetic acid [1-(2-phenylethyl)-4-piperidinyl] ester
IUPAC NAME: [1-(2-phenylethyl)piperidin-4-yl] 2,2-diphenylacetate
SYSTEMATIC NAME: [1-(2-phenylethyl)piperidin-4-yl] 2,2-diphenylethanoate
MOLECULAR FORMULA: C27H29NO2
MOLECULAR WEIGHT: 399.52466
SMILES: C1CN(CCC1OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC=CC=C4
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Product OPENEYE NAME: 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate hydrochloride
CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(dimethylamino)ethyl ester hydrochloride
IUPAC NAME: 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate hydrochloride
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 2-(4-chloranylphenoxy)ethanoate hydrochloride
MOLECULAR FORMULA: C12H17Cl2NO3
MOLECULAR WEIGHT: 294.17428
SMILES: CN(C)CCOC(=O)COC1=CC=C(C=C1)Cl.Cl
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Product OPENEYE NAME: 2-pyrrolidin-1-ium-1-ylethyl 4-propoxybenzoate chloride
CAS Name: 4-propoxybenzoic acid 2-(1-pyrrolidin-1-iumyl)ethyl ester chloride
IUPAC NAME: 2-pyrrolidin-1-ium-1-ylethyl 4-propoxybenzoate chloride
SYSTEMATIC NAME: 2-pyrrolidin-1-ium-1-ylethyl 4-propoxybenzoate chloride
MOLECULAR FORMULA: C16H24ClNO3
MOLECULAR WEIGHT: 313.81966
SMILES: CCCOC1=CC=C(C=C1)C(=O)OCC[NH+]2CCCC2.[Cl-]
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Product OPENEYE NAME: 2-pyrrolidin-1-ylethyl 4-propoxybenzoate
CAS Name: 4-propoxybenzoic acid 2-(1-pyrrolidinyl)ethyl ester
IUPAC NAME: 2-pyrrolidin-1-ylethyl 4-propoxybenzoate
SYSTEMATIC NAME: 2-pyrrolidin-1-ylethyl 4-propoxybenzoate
MOLECULAR FORMULA: C16H23NO3
MOLECULAR WEIGHT: 277.35872
SMILES: CCCOC1=CC=C(C=C1)C(=O)OCCN2CCCC2
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Product OPENEYE NAME: 4-[[2-oxo-2-(4-phenylphenyl)ethylidene]amino]benzoic acid
CAS Name: 4-[[2-oxo-2-(4-phenylphenyl)ethylidene]amino]benzoic acid
IUPAC NAME: 4-[[2-oxo-2-(4-phenylphenyl)ethylidene]amino]benzoic acid
SYSTEMATIC NAME: 4-[[2-oxidanylidene-2-(4-phenylphenyl)ethylidene]amino]benzoic acid
MOLECULAR FORMULA: C21H15NO3
MOLECULAR WEIGHT: 329.3487
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C=NC3=CC=C(C=C3)C(=O)O
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Product OPENEYE NAME: [4-[(2,2-dichloroacetyl)-methyl-amino]phenyl] 4-methylsulfonylbenzoate
CAS Name: 4-methylsulfonylbenzoic acid [4-[(2,2-dichloro-1-oxoethyl)-methylamino]phenyl] ester
IUPAC NAME: [4-[(2,2-dichloroacetyl)-methylamino]phenyl] 4-methylsulfonylbenzoate
SYSTEMATIC NAME: [4-[2,2-bis(chloranyl)ethanoyl-methyl-amino]phenyl] 4-methylsulfonylbenzoate
MOLECULAR FORMULA: C17H15Cl2NO5S
MOLECULAR WEIGHT: 416.2757
SMILES: CN(C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C(=O)C(Cl)Cl
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Product OPENEYE NAME: 2-(4-amino-2-hydroxy-phenyl)-2H-1,3,4-oxadiazole-5-thione
CAS Name: 2-(4-amino-2-hydroxyphenyl)-2H-1,3,4-oxadiazole-5-thione
IUPAC NAME: 2-(4-amino-2-hydroxyphenyl)-2H-1,3,4-oxadiazole-5-thione
SYSTEMATIC NAME: 2-(4-azanyl-2-oxidanyl-phenyl)-2H-1,3,4-oxadiazole-5-thione
MOLECULAR FORMULA: C8H7N3O2S
MOLECULAR WEIGHT: 209.22508
SMILES: C1=CC(=C(C=C1N)O)C2N=NC(=S)O2
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Product OPENEYE NAME: 1,2-diisothiocyanatoethane
CAS Name: 1,2-diisothiocyanatoethane
IUPAC NAME: 1,2-diisothiocyanatoethane
SYSTEMATIC NAME: 1,2-diisothiocyanatoethane
MOLECULAR FORMULA: C4H4N2S2
MOLECULAR WEIGHT: 144.21796
SMILES: C(CN=C=S)N=C=S
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Product OPENEYE NAME: 2-amino-4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid
CAS Name: 2-amino-4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid
IUPAC NAME: 2-amino-4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid
SYSTEMATIC NAME: 2-azanyl-4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid
MOLECULAR FORMULA: C14H20Cl2N2O2
MOLECULAR WEIGHT: 319.2268
SMILES: C1=CC(=CC=C1CCC(C(=O)O)N)N(CCCl)CCCl
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