(4-cyanophenyl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4-cyanophenyl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-cyanophenyl)methyl 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (4-cyanobenzyl) ester Formula: C25H22N2O4 MolecularWeight: 414.45318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=C(C=C2)C#N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=C(C=C2)C#N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H22N2O4/c26-16-20-11-13-22(14-12-20)17-30-24(28)23(15-19-7-3-1-4-8-19)27-25(29)31-18-21-9-5-2-6-10-21/h1-14,23H,15,17-18H2,(H,27,29)