methyl (E)-4-(4-methylphenyl)-2-(phenylmethoxycarbonylamino)but-2-enoate

Systemtic Name: methyl (E)-4-(4-methylphenyl)-2-(phenylmethoxycarbonylamino)but-2-enoate Openeye Name: methyl (E)-2-(benzyloxycarbonylamino)-4-(p-tolyl)but-2-enoate CAS Name: (E)-4-(4-methylphenyl)-2-(phenylmethoxycarbonylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(4-methylphenyl)-2-(phenylmethoxycarbonylamino)but-2-enoate Traditional Name: (E)-2-(benzyloxycarbonylamino)-4-(p-tolyl)but-2-enoic acid methyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC=C(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C/C=C(\C(=O)OC)/NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21NO4/c1-15-8-10-16(11-9-15)12-13-18(19(22)24-2)21-20(23)25-14-17-6-4-3-5-7-17/h3-11,13H,12,14H2,1-2H3,(H,21,23)/b18-13+