N-[[1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-quinoline-6-carboxamide

Systemtic Name: N-[[1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-quinoline-6-carboxamide Openeye Name: N-[[1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-quinoline-6-carboxamide CAS Name: N-[[1-[2-(2-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N-methyl-6-quinolinecarboxamide IUPAC Name: N-[[1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methylquinoline-6-carboxamide Traditional Name: N-[[1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-quinoline-6-carboxamide Formula: C25H29FN3O+ MolecularWeight: 406.515663

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CCC2=CC=CC=C2F)C(=O)C3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CN(CC1CC[NH+](CC1)CCC2=CC=CC=C2F)C(=O)C3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C25H28FN3O/c1-28(25(30)22-8-9-24-21(17-22)6-4-13-27-24)18-19-10-14-29(15-11-19)16-12-20-5-2-3-7-23(20)26/h2-9,13,17,19H,10-12,14-16,18H2,1H3/p+1