O1-ethyl O3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-(4-methylanilino)-2-oxo-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-(4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-(4-methylanilino)-2-oxo-1-phenylethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-1-phenyl-2-(p-toluidino)ethyl] ester Formula: C25H22N2O7 MolecularWeight: 462.45138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C25H22N2O7/c1-3-33-24(29)18-13-19(15-21(14-18)27(31)32)25(30)34-22(17-7-5-4-6-8-17)23(28)26-20-11-9-16(2)10-12-20/h4-15,22H,3H2,1-2H3,(H,26,28)