2-(2-methylphenyl)-N-[8-[[2-(2-methylphenyl)quinolin-4-yl]carbonylamino]octyl]quinoline-4-carboxamide

Systemtic Name: 2-(2-methylphenyl)-N-[8-[[2-(2-methylphenyl)quinolin-4-yl]carbonylamino]octyl]quinoline-4-carboxamide Openeye Name: 2-(o-tolyl)-N-[8-[[2-(o-tolyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide CAS Name: 2-(2-methylphenyl)-N-[8-[[[2-(2-methylphenyl)-4-quinolinyl]-oxomethyl]amino]octyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-methylphenyl)-N-[8-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide Traditional Name: 2-(o-tolyl)-N-[8-[[2-(o-tolyl)quinoline-4-carbonyl]amino]octyl]cinchoninamide Formula: C42H42N4O2 MolecularWeight: 634.80848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6C

InChI

InChI=1S/C42H42N4O2/c1-29-17-7-9-19-31(29)39-27-35(33-21-11-13-23-37(33)45-39)41(47)43-25-15-5-3-4-6-16-26-44-42(48)36-28-40(32-20-10-8-18-30(32)2)46-38-24-14-12-22-34(36)38/h7-14,17-24,27-28H,3-6,15-16,25-26H2,1-2H3,(H,43,47)(H,44,48)