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

Systemtic Name: 3-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: 3-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: 3-[4-(2-chlorophenyl)-1-piperazin-1-iumyl]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: 3-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(2-ketopyrrolidino)phenyl]propionamide Formula: C23H28ClN4O2+ MolecularWeight: 427.94702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H27ClN4O2/c24-20-4-1-2-5-21(20)27-16-14-26(15-17-27)13-11-22(29)25-18-7-9-19(10-8-18)28-12-3-6-23(28)30/h1-2,4-5,7-10H,3,6,11-17H2,(H,25,29)/p+1