(2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]propanamide

Systemtic Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]propanamide Openeye Name: (2S)-2-(4-benzylpiperazin-1-yl)-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-[4-(phenylmethyl)-1-piperazinyl]propanamide IUPAC Name: (2S)-2-(4-benzylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)propanamide Traditional Name: (2S)-2-(4-benzylpiperazino)-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C22H29N3O2 MolecularWeight: 367.48456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2/c1-17-9-10-21(27-3)20(15-17)23-22(26)18(2)25-13-11-24(12-14-25)16-19-7-5-4-6-8-19/h4-10,15,18H,11-14,16H2,1-3H3,(H,23,26)/t18-/m0/s1