5-(5-carboxy-3-oxidanylidene-1H-pyrazol-2-yl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(5-carboxy-3-oxidanylidene-1H-pyrazol-2-yl)benzene-1,3-dicarboxylic acid Openeye Name: 5-(5-carboxy-3-oxo-1H-pyrazol-2-yl)benzene-1,3-dicarboxylic acid CAS Name: 5-(5-carboxy-3-oxo-1H-pyrazol-2-yl)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(5-carboxy-3-oxo-1H-pyrazol-2-yl)benzene-1,3-dicarboxylic acid Traditional Name: 5-(3-carboxy-5-keto-3-pyrazolin-1-yl)isophthalic acid Formula: C12H8N2O7 MolecularWeight: 292.20112

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)N2C(=O)C=C(N2)C(=O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)N2C(=O)C=C(N2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H8N2O7/c15-9-4-8(12(20)21)13-14(9)7-2-5(10(16)17)1-6(3-7)11(18)19/h1-4,13H,(H,16,17)(H,18,19)(H,20,21)