O1-methyl O4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-(4-nitrophenyl)-2-oxo-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-(4-nitrophenyl)-2-oxoethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-(4-nitrophenyl)ethyl] ester O1-methyl ester Formula: C17H13NO7 MolecularWeight: 343.28762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO7/c1-24-16(20)12-2-4-13(5-3-12)17(21)25-10-15(19)11-6-8-14(9-7-11)18(22)23/h2-9H,10H2,1H3