3-[(5E)-5-[[3-chloranyl-1-(3,4-dimethylphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]benzoic acid

Systemtic Name: 3-[(5E)-5-[[3-chloranyl-1-(3,4-dimethylphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]benzoic acid Openeye Name: 3-[(5E)-5-[[3-chloro-1-(3,4-dimethylphenyl)-5-oxo-4H-pyrazol-4-yl]hydrazono]-6-oxo-cyclohexa-1,3-dien-1-yl]benzoic acid CAS Name: 3-[(5E)-5-[[3-chloro-1-(3,4-dimethylphenyl)-5-oxo-4H-pyrazol-4-yl]hydrazinylidene]-6-oxo-1-cyclohexa-1,3-dienyl]benzoic acid IUPAC Name: 3-[(5E)-5-[[3-chloro-1-(3,4-dimethylphenyl)-5-oxo-4H-pyrazol-4-yl]hydrazinylidene]-6-oxocyclohexa-1,3-dien-1-yl]benzoic acid Traditional Name: 3-[(5E)-5-[[3-chloro-1-(3,4-dimethylphenyl)-5-keto-2-pyrazolin-4-yl]hydrazono]-6-keto-cyclohexa-1,3-dien-1-yl]benzoic acid Formula: C24H19ClN4O4 MolecularWeight: 462.88506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(C(=N2)Cl)NN=C3C=CC=C(C3=O)C4=CC(=CC=C4)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(C(=N2)Cl)N/N=C/3\C=CC=C(C3=O)C4=CC(=CC=C4)C(=O)O)C

InChI

InChI=1S/C24H19ClN4O4/c1-13-9-10-17(11-14(13)2)29-23(31)20(22(25)28-29)27-26-19-8-4-7-18(21(19)30)15-5-3-6-16(12-15)24(32)33/h3-12,20,27H,1-2H3,(H,32,33)/b26-19+