methyl 2-[(4-methylphenyl)carbonylamino]-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl 2-[(4-methylphenyl)carbonylamino]-3-(4-nitrophenyl)propanoate Openeye Name: methyl 2-[(4-methylbenzoyl)amino]-3-(4-nitrophenyl)propanoate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylbenzoyl)amino]-3-(4-nitrophenyl)propanoate Traditional Name: 3-(4-nitrophenyl)-2-(p-toluoylamino)propionic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H18N2O5/c1-12-3-7-14(8-4-12)17(21)19-16(18(22)25-2)11-13-5-9-15(10-6-13)20(23)24/h3-10,16H,11H2,1-2H3,(H,19,21)