2-[1-phenyl-2-(quinolin-4-ylmethylamino)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-phenyl-2-(quinolin-4-ylmethylamino)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-phenyl-2-(4-quinolylmethylamino)pyrrolidin-1-ium-1-yl]acetamide CAS Name: 2-[1-phenyl-2-(4-quinolinylmethylamino)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[1-phenyl-2-(quinolin-4-ylmethylamino)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: 2-[1-phenyl-2-(4-quinolylmethylamino)pyrrolidin-1-ium-1-yl]acetamide Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(CC(=O)N)C2=CC=CC=C2)NCC3=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CC([N+](C1)(CC(=O)N)C2=CC=CC=C2)NCC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C22H24N4O/c23-21(27)16-26(18-7-2-1-3-8-18)14-6-11-22(26)25-15-17-12-13-24-20-10-5-4-9-19(17)20/h1-5,7-10,12-13,22,25H,6,11,14-16H2,(H-,23,27)/p+1