3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide

Systemtic Name: 3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: 3-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: 3-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-3-[4-(o-tolyl)piperazin-1-ium-1-yl]propionamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)NC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)NC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C24H30N4O2/c1-19-5-2-3-6-22(19)27-17-15-26(16-18-27)14-12-23(29)25-20-8-10-21(11-9-20)28-13-4-7-24(28)30/h2-3,5-6,8-11H,4,7,12-18H2,1H3,(H,25,29)/p+1