2-(4-methylphenyl)-N-undecyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-undecyl-quinoline-4-carboxamide Openeye Name: 2-(p-tolyl)-N-undecyl-quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-undecyl-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-undecylquinoline-4-carboxamide Traditional Name: 2-(p-tolyl)-N-undecyl-cinchoninamide Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O/c1-3-4-5-6-7-8-9-10-13-20-29-28(31)25-21-27(23-18-16-22(2)17-19-23)30-26-15-12-11-14-24(25)26/h11-12,14-19,21H,3-10,13,20H2,1-2H3,(H,29,31)