(4-nitrophenyl)methyl 4-[(2-methylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (4-nitrophenyl)methyl 4-[(2-methylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (4-nitrophenyl)methyl 4-(2-methylanilino)-4-oxo-butanoate CAS Name: 4-(2-methylanilino)-4-oxobutanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-(2-methylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(o-toluidino)butyric acid (4-nitrobenzyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-13-4-2-3-5-16(13)19-17(21)10-11-18(22)25-12-14-6-8-15(9-7-14)20(23)24/h2-9H,10-12H2,1H3,(H,19,21)