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

Systemtic Name: 3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-[(2-oxopyrrolidin-1-yl)methyl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-[(2-oxo-1-pyrrolidinyl)methyl]-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-[(2-oxopyrrolidin-1-yl)methyl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-[(2-ketopyrrolidino)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C25H32N3O2+ MolecularWeight: 406.54048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)CN4CCCC4=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)CN4CCCC4=O

InChI

InChI=1S/C25H31N3O2/c29-24-8-5-15-28(24)19-22-6-4-7-23(16-22)25(30)26-17-20-9-11-21(12-10-20)18-27-13-2-1-3-14-27/h4,6-7,9-12,16H,1-3,5,8,13-15,17-19H2,(H,26,30)/p+1