2-oxidanylidene-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-quinoline-4-carboxamide

Systemtic Name: 2-oxidanylidene-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-quinoline-4-carboxamide Openeye Name: 2-oxo-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-quinoline-4-carboxamide CAS Name: 2-oxo-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-1H-quinoline-4-carboxamide IUPAC Name: 2-oxo-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-quinoline-4-carboxamide Traditional Name: 2-keto-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-1H-quinoline-4-carboxamide Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H23N3O2/c26-21-13-19(18-9-3-4-10-20(18)24-21)22(27)23-14-16-7-1-2-8-17(16)15-25-11-5-6-12-25/h1-4,7-10,13H,5-6,11-12,14-15H2,(H,23,27)(H,24,26)/p+1