3-(2-oxidanylidenepyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(2-oxidanylidenepyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(2-oxopyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(2-oxo-1-pyrrolidinyl)-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(2-oxopyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[4-(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=C(C=C2)CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C23H27N3O2/c27-22-7-4-14-26(22)21-6-3-5-20(15-21)23(28)24-16-18-8-10-19(11-9-18)17-25-12-1-2-13-25/h3,5-6,8-11,15H,1-2,4,7,12-14,16-17H2,(H,24,28)/p+1