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

Systemtic Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide Openeye Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide CAS Name: N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-quinolinecarboxamide IUPAC Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoline-2-carboxamide Traditional Name: N-[4-(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=C(C=C2)CNC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=NC4=CC=CC=C4C=C3

InChI

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