2-[[(3E)-3-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[(3E)-3-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid Openeye Name: 2-[[(3E)-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)hydrazono]-4-oxo-cyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid CAS Name: 2-[[(3E)-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)hydrazinylidene]-4-oxo-1-cyclohexa-1,5-dienyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[(3E)-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)hydrazinylidene]-4-oxocyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid Traditional Name: 2-[[(3E)-4-keto-3-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)hydrazono]cyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid Formula: C23H19N5O6S MolecularWeight: 493.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1NN=C2C=C(C=CC2=O)S(=O)(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1N/N=C/2\C=C(C=CC2=O)S(=O)(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5O6S/c1-14-21(22(30)28(26-14)15-7-3-2-4-8-15)25-24-19-13-16(11-12-20(19)29)35(33,34)27-18-10-6-5-9-17(18)23(31)32/h2-13,21,25,27H,1H3,(H,31,32)/b24-19+