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

Systemtic Name: 2-(4-ethoxyphenyl)-N-[8-[[2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]octyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-N-[8-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[8-[[[2-(4-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]octyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-N-[8-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide Traditional Name: 2-p-phenetyl-N-[8-[(2-p-phenetylquinoline-4-carbonyl)amino]octyl]cinchoninamide Formula: C44H46N4O4 MolecularWeight: 694.86044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=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)OCC

Isomeric SMILES

CCOC1=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)OCC

InChI

InChI=1S/C44H46N4O4/c1-3-51-33-23-19-31(20-24-33)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(48-40-18-12-10-16-36(38)40)32-21-25-34(26-22-32)52-4-2/h9-12,15-26,29-30H,3-8,13-14,27-28H2,1-2H3,(H,45,49)(H,46,50)