2-(4-ethoxyphenyl)-N-[3-[[2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]-4-phenyldiazenyl-phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-[3-[[2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]-4-phenyldiazenyl-phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-N-[3-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-4-phenylazo-phenyl]quinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[3-[[[2-(4-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-4-phenyldiazenylphenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-N-[3-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-4-phenyldiazenylphenyl]quinoline-4-carboxamide Traditional Name: N-[4-phenylazo-3-[(2-p-phenetylquinoline-4-carbonyl)amino]phenyl]-2-p-phenetyl-cinchoninamide Formula: C48H38N6O4 MolecularWeight: 762.85312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=C(C=C4)N=NC5=CC=CC=C5)NC(=O)C6=CC(=NC7=CC=CC=C76)C8=CC=C(C=C8)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=C(C=C4)N=NC5=CC=CC=C5)NC(=O)C6=CC(=NC7=CC=CC=C76)C8=CC=C(C=C8)OCC

InChI

InChI=1S/C48H38N6O4/c1-3-57-35-23-18-31(19-24-35)44-29-39(37-14-8-10-16-41(37)50-44)47(55)49-34-22-27-43(54-53-33-12-6-5-7-13-33)46(28-34)52-48(56)40-30-45(51-42-17-11-9-15-38(40)42)32-20-25-36(26-21-32)58-4-2/h5-30H,3-4H2,1-2H3,(H,49,55)(H,52,56)