3-(2-oxidanylidenepyrrolidin-1-yl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(2-oxidanylidenepyrrolidin-1-yl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(2-oxopyrrolidin-1-yl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(2-oxo-1-pyrrolidinyl)-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(2-oxopyrrolidin-1-yl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C23H27N3O2/c27-22-11-6-14-26(22)21-10-5-9-18(15-21)23(28)24-16-19-7-1-2-8-20(19)17-25-12-3-4-13-25/h1-2,5,7-10,15H,3-4,6,11-14,16-17H2,(H,24,28)/p+1