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

Systemtic Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide Openeye Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide CAS Name: N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-quinolinecarboxamide IUPAC Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide Traditional Name: N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]quinaldamide Formula: C22H24N3O+ MolecularWeight: 346.44546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23N3O/c26-22(21-12-11-17-7-3-4-10-20(17)24-21)23-15-18-8-1-2-9-19(18)16-25-13-5-6-14-25/h1-4,7-12H,5-6,13-16H2,(H,23,26)/p+1