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

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C23H32N3O+ MolecularWeight: 366.51968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N[C@H](C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O/c1-19-8-6-7-11-22(19)26-16-14-25(15-17-26)18-23(27)24-20(2)12-13-21-9-4-3-5-10-21/h3-11,20H,12-18H2,1-2H3,(H,24,27)/p+1/t20-/m1/s1