(3E)-3-[2-(2-methylphenyl)-1H-pyrazol-3-ylidene]-6-oxidanyl-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: (3E)-3-[2-(2-methylphenyl)-1H-pyrazol-3-ylidene]-6-oxidanyl-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: (3E)-6-hydroxy-3-[2-(o-tolyl)-1H-pyrazol-3-ylidene]-4-oxo-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: (3E)-6-hydroxy-3-[2-(2-methylphenyl)-1H-pyrazol-3-ylidene]-4-oxo-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: (3E)-6-hydroxy-3-[2-(2-methylphenyl)-1H-pyrazol-3-ylidene]-4-oxocyclohexa-1,5-diene-1-carboxylic acid Traditional Name: (3E)-6-hydroxy-4-keto-3-[2-(o-tolyl)-3-pyrazolin-3-ylidene]cyclohexa-1,5-diene-1-carboxylic acid Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C3C=C(C(=CC3=O)O)C(=O)O)C=CN2

Isomeric SMILES

CC1=CC=CC=C1N2/C(=C/3\C=C(C(=CC3=O)O)C(=O)O)/C=CN2

InChI

InChI=1S/C17H14N2O4/c1-10-4-2-3-5-13(10)19-14(6-7-18-19)11-8-12(17(22)23)16(21)9-15(11)20/h2-9,18,21H,1H3,(H,22,23)/b14-11+