2-(1-methylpyrazol-4-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-(1-methylpyrazol-4-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-(1-methylpyrazol-4-yl)-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-(1-methyl-4-pyrazolyl)-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-(1-methylpyrazol-4-yl)-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-(1-methylpyrazol-4-yl)isoindoline-5-carboxylic acid Formula: C13H9N3O4 MolecularWeight: 271.22826

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

InChI

InChI=1S/C13H9N3O4/c1-15-6-8(5-14-15)16-11(17)9-3-2-7(13(19)20)4-10(9)12(16)18/h2-6H,1H3,(H,19,20)