propan-2-yl 2-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-oxidanylidene-ethanoate

Systemtic Name: propan-2-yl 2-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-oxidanylidene-ethanoate Openeye Name: isopropyl 2-(3,4-dihydroxy-5-nitro-phenyl)-2-oxo-acetate CAS Name: 2-(3,4-dihydroxy-5-nitrophenyl)-2-oxoacetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(3,4-dihydroxy-5-nitrophenyl)-2-oxoacetate Traditional Name: 2-(3,4-dihydroxy-5-nitro-phenyl)-2-keto-acetic acid isopropyl ester Formula: C11H11NO7 MolecularWeight: 269.20754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO7/c1-5(2)19-11(16)9(14)6-3-7(12(17)18)10(15)8(13)4-6/h3-5,13,15H,1-2H3