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

Systemtic Name: 2-(4-ethylphenyl)-N-[8-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]octyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-N-[8-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-[8-[[[2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]octyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-[8-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-N-[8-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]octyl]cinchoninamide Formula: C44H46N4O2 MolecularWeight: 662.86164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(C=C6)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(C=C6)CC

InChI

InChI=1S/C44H46N4O2/c1-3-31-19-23-33(24-20-31)41-29-37(35-15-9-11-17-39(35)47-41)43(49)45-27-13-7-5-6-8-14-28-46-44(50)38-30-42(34-25-21-32(4-2)22-26-34)48-40-18-12-10-16-36(38)40/h9-12,15-26,29-30H,3-8,13-14,27-28H2,1-2H3,(H,45,49)(H,46,50)