ethyl (2S)-6-cyano-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: ethyl (2S)-6-cyano-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: ethyl (2S)-2-(benzyloxycarbonylamino)-6-cyano-hexanoate CAS Name: (2S)-6-cyano-2-(phenylmethoxycarbonylamino)hexanoic acid ethyl ester IUPAC Name: ethyl (2S)-6-cyano-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-6-cyano-hexanoic acid ethyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCC#N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@H](CCCCC#N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H22N2O4/c1-2-22-16(20)15(11-7-4-8-12-18)19-17(21)23-13-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11,13H2,1H3,(H,19,21)/t15-/m0/s1