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

Systemtic Name: 3-(2-oxidanylidenepyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(2-oxopyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(2-oxo-1-pyrrolidinyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(2-oxopyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C24H30N3O2+ MolecularWeight: 392.5139

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C24H29N3O2/c28-23-12-7-15-27(23)22-11-6-10-19(16-22)24(29)25-17-20-8-2-3-9-21(20)18-26-13-4-1-5-14-26/h2-3,6,8-11,16H,1,4-5,7,12-15,17-18H2,(H,25,29)/p+1