Product OPENEYE NAME: 3-[(E)-2-carboxyvinyl]sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CAS Name: 3-[[(E)-2-carboxyethenyl]thio]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
IUPAC NAME: 3-[(E)-2-carboxyethenyl]sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
SYSTEMATIC NAME: 6-(1-hydroxyethyl)-7-oxidanylidene-3-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
MOLECULAR FORMULA: C12H12NO6S-
MOLECULAR WEIGHT: 298.29178
SMILES: CC(C1C2CC(=C(N2C1=O)C(=O)[O-])S/C=C/C(=O)O)O
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Product OPENEYE NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CAS Name: 3-(2-acetamidoethylthio)-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
IUPAC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
SYSTEMATIC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
MOLECULAR FORMULA: C13H17N2O5S-
MOLECULAR WEIGHT: 313.34948
SMILES: CC(C1C2CC(=C(N2C1=O)C(=O)[O-])SCCNC(=O)C)O
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Product OPENEYE NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CAS Name: 3-(2-acetamidoethylthio)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
IUPAC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
SYSTEMATIC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-methanoyloxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
MOLECULAR FORMULA: C14H17N2O6S-
MOLECULAR WEIGHT: 341.35958
SMILES: CC(C1C2CC(=C(N2C1=O)C(=O)[O-])SCCNC(=O)C)OC=O
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Product OPENEYE NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
CAS Name: 3-(2-acetamidoethylthio)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
IUPAC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-formyloxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(2-acetamidoethylsulfanyl)-6-(1-methanoyloxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H18N2O6S
MOLECULAR WEIGHT: 342.36752
SMILES: CC(C1C2CC(=C(N2C1=O)C(=O)O)SCCNC(=O)C)OC=O
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Product OPENEYE NAME: 3,3-dimethoxy-2-phenyl-propanenitrile
CAS Name: 3,3-dimethoxy-2-phenylpropanenitrile
IUPAC NAME: 3,3-dimethoxy-2-phenylpropanenitrile
SYSTEMATIC NAME: 3,3-dimethoxy-2-phenyl-propanenitrile
MOLECULAR FORMULA: C11H13NO2
MOLECULAR WEIGHT: 191.22642
SMILES: COC(C(C#N)C1=CC=CC=C1)OC
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Product OPENEYE NAME: ammonium hydroxylamine disulfate
CAS Name: ammonium hydroxylamine disulfate
IUPAC NAME: azanium hydroxylamine disulfate
SYSTEMATIC NAME: azanium azinous acid disulfate
MOLECULAR FORMULA: H7N2O9S2-3
MOLECULAR WEIGHT: 243.19358
SMILES: [NH4+].NO.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]
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Product OPENEYE NAME: 3,3-dihydroxypropanenitrile
CAS Name: 3,3-dihydroxypropanenitrile
IUPAC NAME: 3,3-dihydroxypropanenitrile
SYSTEMATIC NAME: 3,3-bis(oxidanyl)propanenitrile
MOLECULAR FORMULA: C3H5NO2
MOLECULAR WEIGHT: 87.0773
SMILES: C(C#N)C(O)O
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Product OPENEYE NAME: 3-(trifluoromethyl)benzonitrile; 4-(trifluoromethyl)benzonitrile
CAS Name: 3-(trifluoromethyl)benzonitrile; 4-(trifluoromethyl)benzonitrile
IUPAC NAME: 3-(trifluoromethyl)benzonitrile; 4-(trifluoromethyl)benzonitrile
SYSTEMATIC NAME: 3-(trifluoromethyl)benzenecarbonitrile; 4-(trifluoromethyl)benzenecarbonitrile
MOLECULAR FORMULA: C16H8F6N2
MOLECULAR WEIGHT: 342.238539
SMILES: C1=CC(=CC(=C1)C(F)(F)F)C#N.C1=CC(=CC=C1C#N)C(F)(F)F
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Product OPENEYE NAME: (4-chlorophenyl)-[4-(trifluoromethylsulfanyl)phenyl]methanone
CAS Name: (4-chlorophenyl)-[4-(trifluoromethylthio)phenyl]methanone
IUPAC NAME: (4-chlorophenyl)-[4-(trifluoromethylsulfanyl)phenyl]methanone
SYSTEMATIC NAME: (4-chlorophenyl)-[4-(trifluoromethylsulfanyl)phenyl]methanone
MOLECULAR FORMULA: C14H8ClF3OS
MOLECULAR WEIGHT: 316.72593
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)SC(F)(F)F
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Product OPENEYE NAME: 3-(trifluoromethyl)thiophene-2-carbaldehyde
CAS Name: 3-(trifluoromethyl)-2-thiophenecarboxaldehyde
IUPAC NAME: 3-(trifluoromethyl)thiophene-2-carbaldehyde
SYSTEMATIC NAME: 3-(trifluoromethyl)thiophene-2-carbaldehyde
MOLECULAR FORMULA: C6H3F3OS
MOLECULAR WEIGHT: 180.14763
SMILES: C1=CSC(=C1C(F)(F)F)C=O
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Product OPENEYE NAME: N'-[3-(dimethylamino)propyl]butanediamide
CAS Name: N'-[3-(dimethylamino)propyl]butanediamide
IUPAC NAME: N'-[3-(dimethylamino)propyl]butanediamide
SYSTEMATIC NAME: N'-[3-(dimethylamino)propyl]butanediamide
MOLECULAR FORMULA: C9H19N3O2
MOLECULAR WEIGHT: 201.26606
SMILES: CN(C)CCCNC(=O)CCC(=O)N
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Product OPENEYE NAME: 4-[1-(dimethylamino)ethoxy]-4-oxo-butanoate
CAS Name: 4-[1-(dimethylamino)ethoxy]-4-oxobutanoate
IUPAC NAME: 4-[1-(dimethylamino)ethoxy]-4-oxobutanoate
SYSTEMATIC NAME: 4-[1-(dimethylamino)ethoxy]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C8H14NO4-
MOLECULAR WEIGHT: 188.20106
SMILES: CC(N(C)C)OC(=O)CCC(=O)[O-]
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Product OPENEYE NAME: 4-[1-(dimethylamino)ethoxy]-4-oxo-butanoic acid
CAS Name: 4-[1-(dimethylamino)ethoxy]-4-oxobutanoic acid
IUPAC NAME: 4-[1-(dimethylamino)ethoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[1-(dimethylamino)ethoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C8H15NO4
MOLECULAR WEIGHT: 189.209
SMILES: CC(N(C)C)OC(=O)CCC(=O)O
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Product OPENEYE NAME: benzyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; hydrate
CAS Name: benzoic acid (phenylmethyl) ester; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; hydrate
IUPAC NAME: benzyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; hydrate
SYSTEMATIC NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; (phenylmethyl) benzoate; hydrate
MOLECULAR FORMULA: C28H36N2O4
MOLECULAR WEIGHT: 464.59644
SMILES: CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2.O
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Product OPENEYE NAME: benzyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide
CAS Name: benzoic acid (phenylmethyl) ester; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide
IUPAC NAME: benzyl benzoate; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; (phenylmethyl) benzoate
MOLECULAR FORMULA: C28H34N2O3
MOLECULAR WEIGHT: 446.58116
SMILES: CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; phenylmethanol
CAS Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; phenylmethanol
IUPAC NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; phenylmethanol
SYSTEMATIC NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; phenylmethanol
MOLECULAR FORMULA: C21H30N2O2
MOLECULAR WEIGHT: 342.4751
SMILES: CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C1=CC=C(C=C1)CO
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Product OPENEYE NAME: 1-butoxyethyl diphenyl phosphate
CAS Name: phosphoric acid 1-butoxyethyl diphenyl ester
IUPAC NAME: 1-butoxyethyl diphenyl phosphate
SYSTEMATIC NAME: 1-butoxyethyl diphenyl phosphate
MOLECULAR FORMULA: C18H23O5P
MOLECULAR WEIGHT: 350.345981
SMILES: CCCCOC(C)OP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
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Product OPENEYE NAME: 1,1-dibutoxyethyl phenyl phosphate
CAS Name: 1,1-dibutoxyethyl phenyl phosphate
IUPAC NAME: 1,1-dibutoxyethyl phenyl phosphate
SYSTEMATIC NAME: 1,1-dibutoxyethyl phenyl phosphate
MOLECULAR FORMULA: C16H26O6P-
MOLECULAR WEIGHT: 345.347801
SMILES: CCCCOC(C)(OCCCC)OP(=O)([O-])OC1=CC=CC=C1
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Product OPENEYE NAME: 1,1-dibutoxyethyl phenyl hydrogen phosphate
CAS Name: 1,1-dibutoxyethyl phenyl hydrogen phosphate
IUPAC NAME: 1,1-dibutoxyethyl phenyl hydrogen phosphate
SYSTEMATIC NAME: 1,1-dibutoxyethyl phenyl hydrogen phosphate
MOLECULAR FORMULA: C16H27O6P
MOLECULAR WEIGHT: 346.355741
SMILES: CCCCOC(C)(OCCCC)OP(=O)(O)OC1=CC=CC=C1
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Product OPENEYE NAME: oxido(dioxo)vanadium; uranium
CAS Name: oxido(dioxo)vanadium; uranium
IUPAC NAME: oxido(dioxo)vanadium; uranium
SYSTEMATIC NAME: oxidanidyl-bis(oxidanylidene)vanadium; uranium
MOLECULAR FORMULA: O18UV6-6
MOLECULAR WEIGHT: 831.66711
SMILES: [O-][V](=O)=O.[O-][V](=O)=O.[O-][V](=O)=O.[O-][V](=O)=O.[O-][V](=O)=O.[O-][V](=O)=O.[U]
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Product OPENEYE NAME: oxygen(2-); thallium(3+); hydrate
CAS Name: oxygen(2-); thallium(3+); hydrate
IUPAC NAME: oxygen(2-); thallium(3+); hydrate
SYSTEMATIC NAME: oxygen(2-); thallium(3+); hydrate
MOLECULAR FORMULA: H2O4Tl2
MOLECULAR WEIGHT: 474.78008
SMILES: O.[O-2].[O-2].[O-2].[Tl+3].[Tl+3]
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Product OPENEYE NAME: thallium(3+) trihydroxide
CAS Name: thallium(3+) trihydroxide
IUPAC NAME: thallium(3+) trihydroxide
SYSTEMATIC NAME: thallium(3+) trihydroxide
MOLECULAR FORMULA: H3O3Tl
MOLECULAR WEIGHT: 255.40532
SMILES: [OH-].[OH-].[OH-].[Tl+3]
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