2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[4-(1-naphthalenylmethyl)-1-piperazin-1-iumyl]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C27H31N4O2+ MolecularWeight: 443.56064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H30N4O2/c32-26(28-23-10-12-24(13-11-23)31-14-4-9-27(31)33)20-30-17-15-29(16-18-30)19-22-7-3-6-21-5-1-2-8-25(21)22/h1-3,5-8,10-13H,4,9,14-20H2,(H,28,32)/p+1