Product OPENEYE NAME: disodium 3-carboxy-4-chloro-4,5-dihydroxy-5-oxo-pentanoate
CAS Name: disodium 3-carboxy-4-chloro-4,5-dihydroxy-5-oxopentanoate
IUPAC NAME: disodium 3-carboxy-4-chloro-4,5-dihydroxy-5-oxopentanoate
SYSTEMATIC NAME: disodium 3-carboxy-4-chloranyl-4,5-bis(oxidanyl)-5-oxidanylidene-pentanoate
MOLECULAR FORMULA: C12H12Cl2Na2O14
MOLECULAR WEIGHT: 497.10082
SMILES: C(C(C(=O)O)C(C(=O)O)(O)Cl)C(=O)[O-].C(C(C(=O)O)C(C(=O)O)(O)Cl)C(=O)[O-].[Na+].[Na+]
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Product OPENEYE NAME: 1-chloro-1-hydroxy-propane-1,2,3-tricarboxylic acid
CAS Name: 1-chloro-1-hydroxypropane-1,2,3-tricarboxylic acid
IUPAC NAME: 1-chloro-1-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 1-chloranyl-1-oxidanyl-propane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C6H7ClO7
MOLECULAR WEIGHT: 226.56858
SMILES: C(C(C(=O)O)C(C(=O)O)(O)Cl)C(=O)O
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Product OPENEYE NAME: 2-hydroxy-3-methylsulfonyloxy-butane-1,2,3-tricarboxylate
CAS Name: 2-hydroxy-3-methylsulfonyloxybutane-1,2,3-tricarboxylate
IUPAC NAME: 2-hydroxy-3-methylsulfonyloxybutane-1,2,3-tricarboxylate
SYSTEMATIC NAME: 3-methylsulfonyloxy-2-oxidanyl-butane-1,2,3-tricarboxylate
MOLECULAR FORMULA: C8H9O10S-3
MOLECULAR WEIGHT: 297.21606
SMILES: CC(C(=O)[O-])(C(CC(=O)[O-])(C(=O)[O-])O)OS(=O)(=O)C
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Product OPENEYE NAME: 2-hydroxy-3-methylsulfonyloxy-butane-1,2,3-tricarboxylic acid
CAS Name: 2-hydroxy-3-methylsulfonyloxybutane-1,2,3-tricarboxylic acid
IUPAC NAME: 2-hydroxy-3-methylsulfonyloxybutane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 3-methylsulfonyloxy-2-oxidanyl-butane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C8H12O10S
MOLECULAR WEIGHT: 300.23988
SMILES: CC(C(=O)O)(C(CC(=O)O)(C(=O)O)O)OS(=O)(=O)C
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Product OPENEYE NAME: disodium 1-chloro-2-hydroxy-propane-1,2,3-tricarboxylic acid
CAS Name: disodium 1-chloro-2-hydroxypropane-1,2,3-tricarboxylic acid
IUPAC NAME: disodium 1-chloro-2-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: disodium 1-chloranyl-2-oxidanyl-propane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C6H7ClNa2O7+2
MOLECULAR WEIGHT: 272.54812
SMILES: C(C(=O)O)C(C(C(=O)O)Cl)(C(=O)O)O.[Na+].[Na+]
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Product OPENEYE NAME: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxy-butane-1,2,3-tricarboxylate
CAS Name: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxybutane-1,2,3-tricarboxylate
IUPAC NAME: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxybutane-1,2,3-tricarboxylate
SYSTEMATIC NAME: 1,1-dimethyl-3-methylsulfonyloxy-2-oxidanyl-butane-1,2,3-tricarboxylate
MOLECULAR FORMULA: C10H13O10S-3
MOLECULAR WEIGHT: 325.26922
SMILES: CC(C)(C(=O)[O-])C(C(=O)[O-])(C(C)(C(=O)[O-])OS(=O)(=O)C)O
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Product OPENEYE NAME: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxy-butane-1,2,3-tricarboxylic acid
CAS Name: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxybutane-1,2,3-tricarboxylic acid
IUPAC NAME: 2-hydroxy-1,1-dimethyl-3-methylsulfonyloxybutane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 1,1-dimethyl-3-methylsulfonyloxy-2-oxidanyl-butane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C10H16O10S
MOLECULAR WEIGHT: 328.29304
SMILES: CC(C)(C(=O)O)C(C(=O)O)(C(C)(C(=O)O)OS(=O)(=O)C)O
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Product OPENEYE NAME: 3-bromo-2,2-diethoxy-propanoate
CAS Name: 3-bromo-2,2-diethoxypropanoate
IUPAC NAME: 3-bromo-2,2-diethoxypropanoate
SYSTEMATIC NAME: 3-bromanyl-2,2-diethoxy-propanoate
MOLECULAR FORMULA: C7H12BrO4-
MOLECULAR WEIGHT: 240.07178
SMILES: CCOC(CBr)(C(=O)[O-])OCC
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Product OPENEYE NAME: ethyl 3,3-diethoxy-4-oxo-2H-pyran-5-carboxylate
CAS Name: 3,3-diethoxy-4-oxo-2H-pyran-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 3,3-diethoxy-4-oxo-2H-pyran-5-carboxylate
SYSTEMATIC NAME: ethyl 3,3-diethoxy-4-oxidanylidene-2H-pyran-5-carboxylate
MOLECULAR FORMULA: C12H18O6
MOLECULAR WEIGHT: 258.26772
SMILES: CCOC(=O)C1=COCC(C1=O)(OCC)OCC
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Product OPENEYE NAME: 5-hydroxy-2-methyl-4-oxo-pyran-3-carboxylic acid
CAS Name: 5-hydroxy-2-methyl-4-oxo-3-pyrancarboxylic acid
IUPAC NAME: 5-hydroxy-2-methyl-4-oxopyran-3-carboxylic acid
SYSTEMATIC NAME: 2-methyl-5-oxidanyl-4-oxidanylidene-pyran-3-carboxylic acid
MOLECULAR FORMULA: C7H6O5
MOLECULAR WEIGHT: 170.11954
SMILES: CC1=C(C(=O)C(=CO1)O)C(=O)O
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Product OPENEYE NAME: 5-(2-bromo-1,1-diethoxy-ethyl)-3-methyl-2H-1,2,5-oxadiazole
CAS Name: 5-(2-bromo-1,1-diethoxyethyl)-3-methyl-2H-1,2,5-oxadiazole
IUPAC NAME: 5-(2-bromo-1,1-diethoxyethyl)-3-methyl-2H-1,2,5-oxadiazole
SYSTEMATIC NAME: 5-(2-bromanyl-1,1-diethoxy-ethyl)-3-methyl-2H-1,2,5-oxadiazole
MOLECULAR FORMULA: C9H17BrN2O3
MOLECULAR WEIGHT: 281.14688
SMILES: CCOC(CBr)(N1C=C(NO1)C)OCC
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Product OPENEYE NAME: 2-bromo-1-(3-methyl-2H-1,2,5-oxadiazol-5-yl)ethanone
CAS Name: 2-bromo-1-(3-methyl-2H-1,2,5-oxadiazol-5-yl)ethanone
IUPAC NAME: 2-bromo-1-(3-methyl-2H-1,2,5-oxadiazol-5-yl)ethanone
SYSTEMATIC NAME: 2-bromanyl-1-(3-methyl-2H-1,2,5-oxadiazol-5-yl)ethanone
MOLECULAR FORMULA: C5H7BrN2O2
MOLECULAR WEIGHT: 207.02528
SMILES: CC1=CN(ON1)C(=O)CBr
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Product OPENEYE NAME: 5-hydroxy-4-oxo-pyran-3-carboxylic acid
CAS Name: 5-hydroxy-4-oxo-3-pyrancarboxylic acid
IUPAC NAME: 5-hydroxy-4-oxopyran-3-carboxylic acid
SYSTEMATIC NAME: 5-oxidanyl-4-oxidanylidene-pyran-3-carboxylic acid
MOLECULAR FORMULA: C6H4O5
MOLECULAR WEIGHT: 156.09296
SMILES: C1=C(C(=O)C(=CO1)O)C(=O)O
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Product OPENEYE NAME: isopentyl 2-hydroxy-2-(prop-2-enoylamino)acetate
CAS Name: 2-hydroxy-2-(1-oxoprop-2-enylamino)acetic acid 3-methylbutyl ester
IUPAC NAME: 3-methylbutyl 2-hydroxy-2-(prop-2-enoylamino)acetate
SYSTEMATIC NAME: 3-methylbutyl 2-oxidanyl-2-(prop-2-enoylamino)ethanoate
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)CCOC(=O)C(NC(=O)C=C)O
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Product OPENEYE NAME: 2-hydroxypropyl 2-(2-hydroxypropoxy)-2-(prop-2-enoylamino)acetate
CAS Name: 2-(2-hydroxypropoxy)-2-(1-oxoprop-2-enylamino)acetic acid 2-hydroxypropyl ester
IUPAC NAME: 2-hydroxypropyl 2-(2-hydroxypropoxy)-2-(prop-2-enoylamino)acetate
SYSTEMATIC NAME: 2-oxidanylpropyl 2-(2-oxidanylpropoxy)-2-(prop-2-enoylamino)ethanoate
MOLECULAR FORMULA: C11H19NO6
MOLECULAR WEIGHT: 261.27166
SMILES: CC(COC(C(=O)OCC(C)O)NC(=O)C=C)O
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