[(4-methylphenyl)carbonylamino] (Z)-3-[(4-nitrophenyl)amino]but-2-enoate

Systemtic Name: [(4-methylphenyl)carbonylamino] (Z)-3-[(4-nitrophenyl)amino]but-2-enoate Openeye Name: [(4-methylbenzoyl)amino] (Z)-3-(4-nitroanilino)but-2-enoate CAS Name: (Z)-3-(4-nitroanilino)-2-butenoic acid [[(4-methylphenyl)-oxomethyl]amino] ester IUPAC Name: [(4-methylbenzoyl)amino] (Z)-3-(4-nitroanilino)but-2-enoate Traditional Name: (Z)-3-(4-nitroanilino)but-2-enoic acid (p-toluoylamino) ester Formula: C18H17N3O5 MolecularWeight: 355.34468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NOC(=O)C=C(C)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NOC(=O)/C=C(/C)\NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5/c1-12-3-5-14(6-4-12)18(23)20-26-17(22)11-13(2)19-15-7-9-16(10-8-15)21(24)25/h3-11,19H,1-2H3,(H,20,23)/b13-11-