7-chloranyl-8-methyl-2-(4-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinoline-4-carboxamide

Systemtic Name: 7-chloranyl-8-methyl-2-(4-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Openeye Name: 7-chloro-8-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 7-chloro-8-methyl-2-(4-methylphenyl)-N-(1-methyl-4-piperidin-1-iumyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-8-methyl-2-(4-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Traditional Name: 7-chloro-8-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(p-tolyl)cinchoninamide Formula: C24H27ClN3O+ MolecularWeight: 408.94368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4CC[NH+](CC4)C

InChI

InChI=1S/C24H26ClN3O/c1-15-4-6-17(7-5-15)22-14-20(19-8-9-21(25)16(2)23(19)27-22)24(29)26-18-10-12-28(3)13-11-18/h4-9,14,18H,10-13H2,1-3H3,(H,26,29)/p+1