(2S)-2-(3-oxidanylidenepiperazin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide

Systemtic Name: (2S)-2-(3-oxidanylidenepiperazin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide Openeye Name: (2S)-2-(3-oxopiperazin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide CAS Name: (2S)-2-(3-oxo-1-piperazinyl)-N-[(2S)-2-phenylbutyl]propanamide IUPAC Name: (2S)-2-(3-oxopiperazin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide Traditional Name: (2S)-2-(3-ketopiperazino)-N-[(2S)-2-phenylbutyl]propionamide Formula: C17H25N3O2 MolecularWeight: 303.3993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C)N1CCNC(=O)C1)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](CNC(=O)[C@H](C)N1CCNC(=O)C1)C2=CC=CC=C2

InChI

InChI=1S/C17H25N3O2/c1-3-14(15-7-5-4-6-8-15)11-19-17(22)13(2)20-10-9-18-16(21)12-20/h4-8,13-14H,3,9-12H2,1-2H3,(H,18,21)(H,19,22)/t13-,14+/m0/s1