methyl (E,2S)-4-(2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoate

Systemtic Name: methyl (E,2S)-4-(2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoate Openeye Name: methyl (E,2S)-2-(benzyloxycarbonylamino)-4-(2-methoxyphenyl)but-3-enoate CAS Name: (E,2S)-4-(2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)-3-butenoic acid methyl ester IUPAC Name: methyl (E,2S)-4-(2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoate Traditional Name: (E,2S)-2-(benzyloxycarbonylamino)-4-(2-methoxyphenyl)but-3-enoic acid methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1/C=C/[C@@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21NO5/c1-24-18-11-7-6-10-16(18)12-13-17(19(22)25-2)21-20(23)26-14-15-8-4-3-5-9-15/h3-13,17H,14H2,1-2H3,(H,21,23)/b13-12+/t17-/m0/s1