ethyl (2R)-4-(2-nitrophenyl)-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: ethyl (2R)-4-(2-nitrophenyl)-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: ethyl (2R)-2-hydroxy-4-(2-nitrophenyl)-4-oxo-butanoate CAS Name: (2R)-2-hydroxy-4-(2-nitrophenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-hydroxy-4-(2-nitrophenyl)-4-oxobutanoate Traditional Name: (2R)-2-hydroxy-4-keto-4-(2-nitrophenyl)butyric acid ethyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)[C@@H](CC(=O)C1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C12H13NO6/c1-2-19-12(16)11(15)7-10(14)8-5-3-4-6-9(8)13(17)18/h3-6,11,15H,2,7H2,1H3/t11-/m1/s1