O1-methyl O4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] butanedioate

Systemtic Name: O1-methyl O4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] butanedioate Openeye Name: O1-methyl O4-[2-(4-nitrophenyl)-2-oxo-ethyl] butanedioate CAS Name: butanedioic acid O1-methyl ester O4-[2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-(4-nitrophenyl)-2-oxoethyl] butanedioate Traditional Name: succinic acid O4-[2-keto-2-(4-nitrophenyl)ethyl] ester O1-methyl ester Formula: C13H13NO7 MolecularWeight: 295.24482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO7/c1-20-12(16)6-7-13(17)21-8-11(15)9-2-4-10(5-3-9)14(18)19/h2-5H,6-8H2,1H3