5-acetamido-2-[[(8E)-2-methyl-5-oxidanylidene-8-(pyridin-2-ylhydrazinylidene)quinolin-3-yl]carbonylamino]benzenesulfonic acid

Systemtic Name: 5-acetamido-2-[[(8E)-2-methyl-5-oxidanylidene-8-(pyridin-2-ylhydrazinylidene)quinolin-3-yl]carbonylamino]benzenesulfonic acid Openeye Name: 5-acetamido-2-[[(8E)-2-methyl-5-oxo-8-(2-pyridylhydrazono)quinoline-3-carbonyl]amino]benzenesulfonic acid CAS Name: 5-acetamido-2-[[[(8E)-2-methyl-5-oxo-8-(2-pyridinylhydrazinylidene)-3-quinolinyl]-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 5-acetamido-2-[[(8E)-2-methyl-5-oxo-8-(pyridin-2-ylhydrazinylidene)quinoline-3-carbonyl]amino]benzenesulfonic acid Traditional Name: 5-acetamido-2-[[(8E)-5-keto-2-methyl-8-(2-pyridylhydrazono)quinoline-3-carbonyl]amino]besylic acid Formula: C24H20N6O6S MolecularWeight: 520.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=O)C=CC(=NNC3=CC=CC=N3)C2=N1)C(=O)NC4=C(C=C(C=C4)NC(=O)C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C2C(=O)C=C/C(=N\NC3=CC=CC=N3)/C2=N1)C(=O)NC4=C(C=C(C=C4)NC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C24H20N6O6S/c1-13-16(24(33)28-18-7-6-15(27-14(2)31)11-21(18)37(34,35)36)12-17-20(32)9-8-19(23(17)26-13)29-30-22-5-3-4-10-25-22/h3-12H,1-2H3,(H,25,30)(H,27,31)(H,28,33)(H,34,35,36)/b29-19+