Product OPENEYE NAME: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 4-(methylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C10H11N2O5S-
MOLECULAR WEIGHT: 271.26974
SMILES: CNC(=O)OCC1C=C(N2C(S1)CC2=O)C(=O)[O-]
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Product OPENEYE NAME: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 4-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 4-(methylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C10H12N2O5S
MOLECULAR WEIGHT: 272.27768
SMILES: CNC(=O)OCC1C=C(N2C(S1)CC2=O)C(=O)O
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Product OPENEYE NAME: benzhydryl 2-(3,4-dihydroxyanilino)oxyacetate
CAS Name: 2-(3,4-dihydroxyanilino)oxyacetic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 2-(3,4-dihydroxyanilino)oxyacetate
SYSTEMATIC NAME: (diphenylmethyl) 2-[[3,4-bis(oxidanyl)phenyl]amino]oxyethanoate
MOLECULAR FORMULA: C21H19NO5
MOLECULAR WEIGHT: 365.37926
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CONC3=CC(=C(C=C3)O)O
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Product OPENEYE NAME: 3-(carbamoyloxymethyl)-7-[carboxy-[(2Z)-2-(3,4-diacetoxyphenyl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(carbamoyloxymethyl)-7-[carboxy-[(2Z)-2-(3,4-diacetyloxyphenyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(carbamoyloxymethyl)-7-[carboxy-[(2Z)-2-(3,4-diacetyloxyphenyl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(aminocarbonyloxymethyl)-7-[carboxy-[(2Z)-2-(3,4-diacetyloxyphenyl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C23H22N4O13S
MOLECULAR WEIGHT: 594.50478
SMILES: CC(=O)OC1=C(C=C(C=C1)/C(=N/OC)/C(=O)N(C2C3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)O)C(=O)O)OC(=O)C
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Product OPENEYE NAME: 2-[3,4-bis(oxomethylene)cyclohexa-1,5-dien-1-yl]-2-(1,3-dioxoisoindolin-2-yl)oxy-acetic acid
CAS Name: 2-[3,4-bis(oxomethylidene)-1-cyclohexa-1,5-dienyl]-2-[(1,3-dioxo-2-isoindolyl)oxy]acetic acid
IUPAC NAME: 2-[3,4-bis(oxomethylidene)cyclohexa-1,5-dien-1-yl]-2-(1,3-dioxoisoindol-2-yl)oxyacetic acid
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-2-[3,4-bis(oxidanylidenemethylidene)cyclohexa-1,5-dien-1-yl]ethanoic acid
MOLECULAR FORMULA: C18H9NO7
MOLECULAR WEIGHT: 351.26656
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)OC(C3=CC(=C=O)C(=C=O)C=C3)C(=O)O
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Product OPENEYE NAME: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 4-(aminocarbonyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C9H9N2O5S-
MOLECULAR WEIGHT: 257.24316
SMILES: C1C2N(C1=O)C(=CC(S2)COC(=O)N)C(=O)[O-]
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Product OPENEYE NAME: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 4-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 4-(aminocarbonyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C9H10N2O5S
MOLECULAR WEIGHT: 258.2511
SMILES: C1C2N(C1=O)C(=CC(S2)COC(=O)N)C(=O)O
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Product OPENEYE NAME: benzhydryl 2-[[1-(3,4-dioxocyclohexa-1,5-dien-1-yl)-2,2-dihydroxy-vinyl]amino]oxyacetate
CAS Name: 2-[[1-(3,4-dioxo-1-cyclohexa-1,5-dienyl)-2,2-dihydroxyethenyl]amino]oxyacetic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 2-[[1-(3,4-dioxocyclohexa-1,5-dien-1-yl)-2,2-dihydroxyethenyl]amino]oxyacetate
SYSTEMATIC NAME: (diphenylmethyl) 2-[[1-[3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-2,2-bis(oxidanyl)ethenyl]amino]oxyethanoate
MOLECULAR FORMULA: C23H19NO7
MOLECULAR WEIGHT: 421.39946
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CONC(=C(O)O)C3=CC(=O)C(=O)C=C3
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Product OPENEYE NAME: 7-[[(Z)-2-(3,4-dioxocyclohexa-1,5-dien-1-yl)-1-hydroxy-2-(methoxyamino)vinyl]amino]-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(Z)-2-(3,4-dioxo-1-cyclohexa-1,5-dienyl)-1-hydroxy-2-(methoxyamino)ethenyl]amino]-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(Z)-2-(3,4-dioxocyclohexa-1,5-dien-1-yl)-1-hydroxy-2-(methoxyamino)ethenyl]amino]-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(Z)-2-[3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-2-(methoxyamino)-1-oxidanyl-ethenyl]amino]-3-(methylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C19H20N4O9S
MOLECULAR WEIGHT: 480.4485
SMILES: CNC(=O)OCC1=C(N2C(C(C2=O)N/C(=C(\C3=CC(=O)C(=O)C=C3)/NOC)/O)SC1)C(=O)O
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Product OPENEYE NAME: 1-(2-hydroxyethoxy)hexan-1-ol
CAS Name: 1-(2-hydroxyethoxy)-1-hexanol
IUPAC NAME: 1-(2-hydroxyethoxy)hexan-1-ol
SYSTEMATIC NAME: 1-(2-hydroxyethyloxy)hexan-1-ol
MOLECULAR FORMULA: C8H18O3
MOLECULAR WEIGHT: 162.22672
SMILES: CCCCCC(O)OCCO
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Product OPENEYE NAME: (1,2-dimethylcyclopentyl)-$l^{1}-silanyloxy-silicon
CAS Name: (1,2-dimethylcyclopentyl)-$l^{1}-silanyloxysilicon
IUPAC NAME: (1,2-dimethylcyclopentyl)-$l^{1}-silanyloxysilicon
SYSTEMATIC NAME: (1,2-dimethylcyclopentyl)-$l^{1}-silanyloxy-silicon
MOLECULAR FORMULA: C7H13OSi2
MOLECULAR WEIGHT: 169.34852
SMILES: CC1CCCC1(C)[Si]O[Si]
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Product OPENEYE NAME: 2-amino-3-(4-hydroxy-3-methoxy-phenyl)propanoic acid
CAS Name: 2-amino-3-(4-hydroxy-3-methoxyphenyl)propanoic acid
IUPAC NAME: 2-amino-3-(4-hydroxy-3-methoxyphenyl)propanoic acid
SYSTEMATIC NAME: 2-azanyl-3-(3-methoxy-4-oxidanyl-phenyl)propanoic acid
MOLECULAR FORMULA: C20H26N2O8
MOLECULAR WEIGHT: 422.42904
SMILES: COC1=C(C=CC(=C1)CC(C(=O)O)N)O.COC1=C(C=CC(=C1)CC(C(=O)O)N)O
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Product OPENEYE NAME: 1-(2-tert-butylphenyl)-2-hydroxy-2-phenyl-ethanone
CAS Name: 1-(2-tert-butylphenyl)-2-hydroxy-2-phenylethanone
IUPAC NAME: 1-(2-tert-butylphenyl)-2-hydroxy-2-phenylethanone
SYSTEMATIC NAME: 1-(2-tert-butylphenyl)-2-oxidanyl-2-phenyl-ethanone
MOLECULAR FORMULA: C18H20O2
MOLECULAR WEIGHT: 268.3502
SMILES: CC(C)(C)C1=CC=CC=C1C(=O)C(C2=CC=CC=C2)O
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Product OPENEYE NAME: 1-aminocyclohexanecarboxylic acid; 2-amino-2-cyclohexyl-acetic acid
CAS Name: 1-amino-1-cyclohexanecarboxylic acid; 2-amino-2-cyclohexylacetic acid
IUPAC NAME: 1-aminocyclohexane-1-carboxylic acid; 2-amino-2-cyclohexylacetic acid
SYSTEMATIC NAME: 1-azanylcyclohexane-1-carboxylic acid; 2-azanyl-2-cyclohexyl-ethanoic acid
MOLECULAR FORMULA: C15H28N2O4
MOLECULAR WEIGHT: 300.39382
SMILES: C1CCC(CC1)C(C(=O)O)N.C1CCC(CC1)(C(=O)O)N
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Product OPENEYE NAME: isoxazolidin-2-yl 4-amino-3,5-dioxo-tetrahydrofuran-2-carboxylate
CAS Name: 4-amino-3,5-dioxo-2-oxolanecarboxylic acid 2-isoxazolidinyl ester
IUPAC NAME: 1,2-oxazolidin-2-yl 4-amino-3,5-dioxooxolane-2-carboxylate
SYSTEMATIC NAME: 1,2-oxazolidin-2-yl 4-azanyl-3,5-bis(oxidanylidene)oxolane-2-carboxylate
MOLECULAR FORMULA: C8H10N2O6
MOLECULAR WEIGHT: 230.1748
SMILES: C1CN(OC1)OC(=O)C2C(=O)C(C(=O)O2)N
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Product OPENEYE NAME: 7-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-3-(3-oxobutanoyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(1,3-dioxobutoxymethyl)-7-[[(2E)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-3-(3-oxobutanoyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-methoxyiminoethanoyl]amino]-8-oxidanylidene-3-(3-oxidanylidenebutanoyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C15H17N3O8S
MOLECULAR WEIGHT: 399.37578
SMILES: CC(=O)CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)/C=N/OC)SC1)C(=O)O
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Product OPENEYE NAME: ethyl 2-ethoxy-1,2-dihydroxy-quinoline-3-carboxylate
CAS Name: 2-ethoxy-1,2-dihydroxy-3-quinolinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-ethoxy-1,2-dihydroxyquinoline-3-carboxylate
SYSTEMATIC NAME: ethyl 2-ethoxy-1,2-bis(oxidanyl)quinoline-3-carboxylate
MOLECULAR FORMULA: C14H17NO5
MOLECULAR WEIGHT: 279.28848
SMILES: CCOC(=O)C1=CC2=CC=CC=C2N(C1(O)OCC)O
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Product OPENEYE NAME: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylate iodide
CAS Name: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylate iodide
IUPAC NAME: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylate iodide
SYSTEMATIC NAME: 3-oxidanylidene-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylate iodide
MOLECULAR FORMULA: C5H3IO4S-2
MOLECULAR WEIGHT: 286.04439
SMILES: C1C2C(S2)(OC1=O)C(=O)[O-].[I-]
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Product OPENEYE NAME: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylic acid
CAS Name: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylic acid
IUPAC NAME: 3-oxo-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylic acid
SYSTEMATIC NAME: 3-oxidanylidene-4-oxa-6-thiabicyclo[3.1.0]hexane-5-carboxylic acid
MOLECULAR FORMULA: C5H4O4S
MOLECULAR WEIGHT: 160.14786
SMILES: C1C2C(S2)(OC1=O)C(=O)O
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Product OPENEYE NAME: 3-(hydroxymethyl)-7-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(hydroxymethyl)-7-[[(2E)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(hydroxymethyl)-7-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(hydroxymethyl)-7-[[(2E)-2-methoxyiminoethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C11H13N3O6S
MOLECULAR WEIGHT: 315.30242
SMILES: CO/N=C/C(=O)NC1C2N(C1=O)C(=C(CS2)CO)C(=O)O
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Product OPENEYE NAME: methylsulfanyl 5-oxotetrahydrofuran-2-carboxylate iodide
CAS Name: 5-oxo-2-oxolanecarboxylic acid (methylthio) ester iodide
IUPAC NAME: methylsulfanyl 5-oxooxolane-2-carboxylate iodide
SYSTEMATIC NAME: methylsulfanyl 5-oxidanylideneoxolane-2-carboxylate iodide
MOLECULAR FORMULA: C6H8IO4S-
MOLECULAR WEIGHT: 303.09479
SMILES: CSOC(=O)C1CCC(=O)O1.[I-]
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Product OPENEYE NAME: methylsulfanyl 5-oxotetrahydrofuran-2-carboxylate
CAS Name: 5-oxo-2-oxolanecarboxylic acid (methylthio) ester
IUPAC NAME: methylsulfanyl 5-oxooxolane-2-carboxylate
SYSTEMATIC NAME: methylsulfanyl 5-oxidanylideneoxolane-2-carboxylate
MOLECULAR FORMULA: C6H8O4S
MOLECULAR WEIGHT: 176.19032
SMILES: CSOC(=O)C1CCC(=O)O1
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Product OPENEYE NAME: methylsulfanyl 5-oxotetrahydrofuran-2-carboxylate bromide
CAS Name: 5-oxo-2-oxolanecarboxylic acid (methylthio) ester bromide
IUPAC NAME: methylsulfanyl 5-oxooxolane-2-carboxylate bromide
SYSTEMATIC NAME: methylsulfanyl 5-oxidanylideneoxolane-2-carboxylate bromide
MOLECULAR FORMULA: C6H8BrO4S-
MOLECULAR WEIGHT: 256.09432
SMILES: CSOC(=O)C1CCC(=O)O1.[Br-]
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