propan-2-yl 2-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-oxidanylidene-ethanoate

Systemtic Name: propan-2-yl 2-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-oxidanylidene-ethanoate Openeye Name: isopropyl 2-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-oxo-acetate CAS Name: 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-oxoacetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-oxoacetate Traditional Name: 2-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-keto-acetic acid isopropyl ester Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO7/c1-6(2)20-12(16)10(14)7-4-8(13(17)18)11(15)9(5-7)19-3/h4-6,15H,1-3H3