N-[[2-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]phenyl]methyl]pyridine-4-carboxamide

Systemtic Name: N-[[2-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]phenyl]methyl]pyridine-4-carboxamide Openeye Name: N-[[2-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]phenyl]methyl]pyridine-4-carboxamide CAS Name: N-[[2-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]phenyl]methyl]-4-pyridinecarboxamide IUPAC Name: N-[[2-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]phenyl]methyl]pyridine-4-carboxamide Traditional Name: N-[2-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzyl]isonicotinamide Formula: C24H26N3O+ MolecularWeight: 372.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4=CC=NC=C4

InChI

InChI=1S/C24H25N3O/c28-24(21-11-13-25-14-12-21)26-17-22-5-1-2-6-23(22)20-9-7-19(8-10-20)18-27-15-3-4-16-27/h1-2,5-14H,3-4,15-18H2,(H,26,28)/p+1