6-chloranyl-2-(2-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-2-(2-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinoline-4-carboxamide Openeye Name: 6-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-2-(o-tolyl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(2-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-quinolinecarboxamide IUPAC Name: 6-chloro-2-(2-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinoline-4-carboxamide Traditional Name: 6-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-2-(o-tolyl)cinchoninamide Formula: C24H27ClN3O2+ MolecularWeight: 424.94308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C24H26ClN3O2/c1-17-5-2-3-6-19(17)23-16-21(20-15-18(25)7-8-22(20)27-23)24(29)26-9-4-10-28-11-13-30-14-12-28/h2-3,5-8,15-16H,4,9-14H2,1H3,(H,26,29)/p+1