2-(4-methylpiperazin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-(4-methylpiperazin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide CAS Name: 2-(4-methyl-1-piperazin-1-iumyl)-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-(4-methylpiperazin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide Formula: C17H28N3O+ MolecularWeight: 290.42372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C

InChI

InChI=1S/C17H27N3O/c1-15(8-9-16-6-4-3-5-7-16)18-17(21)14-20-12-10-19(2)11-13-20/h3-7,15H,8-14H2,1-2H3,(H,18,21)/p+1/t15-/m1/s1