[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-[(phenylmethyl)amino]butanoate

Systemtic Name: [(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-[(phenylmethyl)amino]butanoate Openeye Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-(benzylamino)butanoate CAS Name: 2-[(phenylmethyl)amino]butanoic acid [(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] 2-(benzylamino)butanoate Traditional Name: 2-(benzylamino)butyric acid [(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl] ester Formula: C23H28N2O3 MolecularWeight: 380.48002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C1=CC=CC=C1)C(=O)N2CCCC2)NCC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)O[C@@H](C1=CC=CC=C1)C(=O)N2CCCC2)NCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-2-20(24-17-18-11-5-3-6-12-18)23(27)28-21(19-13-7-4-8-14-19)22(26)25-15-9-10-16-25/h3-8,11-14,20-21,24H,2,9-10,15-17H2,1H3/t20?,21-/m0/s1