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

Systemtic Name: 2-(4-ethylphenyl)-N-[3-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]-4-phenyldiazenyl-phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-N-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-phenylazo-phenyl]quinoline-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-[3-[[[2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]-4-phenyldiazenylphenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-phenyldiazenylphenyl]quinoline-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-N-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-phenylazo-phenyl]cinchoninamide Formula: C48H38N6O2 MolecularWeight: 730.85432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=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)CC

Isomeric SMILES

CCC1=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)CC

InChI

InChI=1S/C48H38N6O2/c1-3-31-18-22-33(23-19-31)44-29-39(37-14-8-10-16-41(37)50-44)47(55)49-36-26-27-43(54-53-35-12-6-5-7-13-35)46(28-36)52-48(56)40-30-45(34-24-20-32(4-2)21-25-34)51-42-17-11-9-15-38(40)42/h5-30H,3-4H2,1-2H3,(H,49,55)(H,52,56)