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

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

Isomeric SMILES

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

InChI

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