dimethyl (E)-2-[(4-nitrophenyl)amino]but-2-enedioate

Systemtic Name: dimethyl (E)-2-[(4-nitrophenyl)amino]but-2-enedioate Openeye Name: dimethyl (E)-2-(4-nitroanilino)but-2-enedioate CAS Name: (E)-2-(4-nitroanilino)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(4-nitroanilino)but-2-enedioate Traditional Name: (E)-2-(4-nitroanilino)but-2-enedioic acid dimethyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)NC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O6/c1-19-11(15)7-10(12(16)20-2)13-8-3-5-9(6-4-8)14(17)18/h3-7,13H,1-2H3/b10-7+