2-methyl-6-phenyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-methyl-6-phenyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-methyl-6-phenyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-methyl-6-phenyl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-methyl-6-phenyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-methyl-6-phenyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]nicotinamide Formula: C25H28N3O+ MolecularWeight: 386.50932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

InChI

InChI=1S/C25H27N3O/c1-19-23(13-14-24(27-19)20-9-3-2-4-10-20)25(29)26-17-21-11-5-6-12-22(21)18-28-15-7-8-16-28/h2-6,9-14H,7-8,15-18H2,1H3,(H,26,29)/p+1