3-methyl-2-(4-methylphenyl)-N-nonyl-quinoline-4-carboxamide

Systemtic Name: 3-methyl-2-(4-methylphenyl)-N-nonyl-quinoline-4-carboxamide Openeye Name: 3-methyl-N-nonyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 3-methyl-2-(4-methylphenyl)-N-nonyl-4-quinolinecarboxamide IUPAC Name: 3-methyl-2-(4-methylphenyl)-N-nonylquinoline-4-carboxamide Traditional Name: 3-methyl-N-nonyl-2-(p-tolyl)cinchoninamide Formula: C27H34N2O MolecularWeight: 402.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCCCCCCCCNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C27H34N2O/c1-4-5-6-7-8-9-12-19-28-27(30)25-21(3)26(22-17-15-20(2)16-18-22)29-24-14-11-10-13-23(24)25/h10-11,13-18H,4-9,12,19H2,1-3H3,(H,28,30)