[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C15H11NO7 MolecularWeight: 317.25034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=C(C=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=C(C=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H11NO7/c17-12-6-3-10(7-13(12)18)15(20)23-8-14(19)9-1-4-11(5-2-9)16(21)22/h1-7,17-18H,8H2