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

Systemtic Name: O1-methyl O4-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl] ester O1-methyl ester Formula: C24H20N2O7 MolecularWeight: 448.4248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C24H20N2O7/c1-15-8-13-19(20(14-15)26(30)31)25-22(27)21(16-6-4-3-5-7-16)33-24(29)18-11-9-17(10-12-18)23(28)32-2/h3-14,21H,1-2H3,(H,25,27)