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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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