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

Systemtic Name: 4-chloranyl-2-(2-oxidanylidenepyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-chloro-2-(2-oxopyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-chloro-2-(2-oxo-1-pyrrolidinyl)-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-chloro-2-(2-oxopyrrolidin-1-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-chloro-2-(2-ketopyrrolidino)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C23H27ClN3O2+ MolecularWeight: 412.93238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26ClN3O2/c24-19-9-10-20(21(14-19)27-13-3-4-22(27)28)23(29)25-15-17-5-7-18(8-6-17)16-26-11-1-2-12-26/h5-10,14H,1-4,11-13,15-16H2,(H,25,29)/p+1