3-methyl-2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-4-carboxamide

Systemtic Name: 3-methyl-2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-4-carboxamide Openeye Name: 3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 3-methyl-2-(4-methylphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 3-methyl-2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-4-carboxamide Traditional Name: 3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(p-tolyl)cinchoninamide Formula: C24H28N3O2+ MolecularWeight: 390.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C24H27N3O2/c1-17-7-9-19(10-8-17)23-18(2)22(20-5-3-4-6-21(20)26-23)24(28)25-11-12-27-13-15-29-16-14-27/h3-10H,11-16H2,1-2H3,(H,25,28)/p+1