N-cyclopropyl-4-methyl-N-[[8-methyl-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-yl]methyl]benzamide

Systemtic Name: N-cyclopropyl-4-methyl-N-[[8-methyl-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-yl]methyl]benzamide Openeye Name: N-cyclopropyl-N-[[2-(4-hydroxy-1-piperidyl)-8-methyl-quinolin-1-ium-3-yl]methyl]-4-methyl-benzamide CAS Name: N-cyclopropyl-N-[[2-(4-hydroxy-1-piperidinyl)-8-methyl-3-quinolin-1-iumyl]methyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-N-[[2-(4-hydroxypiperidin-1-yl)-8-methylquinolin-1-ium-3-yl]methyl]-4-methylbenzamide Traditional Name: N-cyclopropyl-N-[[2-(4-hydroxypiperidino)-8-methyl-quinolin-1-ium-3-yl]methyl]-4-methyl-benzamide Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=C([NH+]=C3C(=CC=CC3=C2)C)N4CCC(CC4)O)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=C([NH+]=C3C(=CC=CC3=C2)C)N4CCC(CC4)O)C5CC5

InChI

InChI=1S/C27H31N3O2/c1-18-6-8-20(9-7-18)27(32)30(23-10-11-23)17-22-16-21-5-3-4-19(2)25(21)28-26(22)29-14-12-24(31)13-15-29/h3-9,16,23-24,31H,10-15,17H2,1-2H3/p+1