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

Systemtic Name: 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 4-[(2-oxopyrrolidin-1-yl)methyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 4-[(2-oxopyrrolidin-1-yl)methyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 4-[(2-ketopyrrolidino)methyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

InChI

InChI=1S/C23H27N3O2/c27-22-4-3-15-26(22)17-19-5-9-20(10-6-19)23(28)24-21-11-7-18(8-12-21)16-25-13-1-2-14-25/h5-12H,1-4,13-17H2,(H,24,28)/p+1