methyl 1-(4-methoxyphenyl)-4,4-bis(oxidanyl)-5-oxidanylidene-pyrazole-3-carboxylate

Systemtic Name: methyl 1-(4-methoxyphenyl)-4,4-bis(oxidanyl)-5-oxidanylidene-pyrazole-3-carboxylate Openeye Name: methyl 4,4-dihydroxy-1-(4-methoxyphenyl)-5-oxo-pyrazole-3-carboxylate CAS Name: 4,4-dihydroxy-1-(4-methoxyphenyl)-5-oxo-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4,4-dihydroxy-1-(4-methoxyphenyl)-5-oxopyrazole-3-carboxylate Traditional Name: 4,4-dihydroxy-5-keto-1-(4-methoxyphenyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(C(=N2)C(=O)OC)(O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(C(=N2)C(=O)OC)(O)O

InChI

InChI=1S/C12H12N2O6/c1-19-8-5-3-7(4-6-8)14-11(16)12(17,18)9(13-14)10(15)20-2/h3-6,17-18H,1-2H3