(3S)-3-phenyl-1-[(2R)-2-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: (3S)-3-phenyl-1-[(2R)-2-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: (3S)-1-[(2R)-2-benzylpiperazin-1-yl]-3-phenyl-butan-1-one CAS Name: (3S)-3-phenyl-1-[(2R)-2-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: (3S)-1-[(2R)-2-benzylpiperazin-1-yl]-3-phenylbutan-1-one Traditional Name: (3S)-1-[(2R)-2-benzylpiperazino]-3-phenyl-butan-1-one Formula: C21H26N2O MolecularWeight: 322.44394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCNCC1CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](CC(=O)N1CCNC[C@H]1CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O/c1-17(19-10-6-3-7-11-19)14-21(24)23-13-12-22-16-20(23)15-18-8-4-2-5-9-18/h2-11,17,20,22H,12-16H2,1H3/t17-,20+/m0/s1