4,5-bis(oxidanylidene)-1-propan-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 4,5-bis(oxidanylidene)-1-propan-2-yl-pyrazole-3-carboxylic acid Openeye Name: 1-isopropyl-4,5-dioxo-pyrazole-3-carboxylic acid CAS Name: 4,5-dioxo-1-propan-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 4,5-dioxo-1-propan-2-ylpyrazole-3-carboxylic acid Traditional Name: 1-isopropyl-4,5-diketo-2-pyrazoline-3-carboxylic acid Formula: C7H8N2O4 MolecularWeight: 184.14942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=O)C(=N1)C(=O)O

Isomeric SMILES

CC(C)N1C(=O)C(=O)C(=N1)C(=O)O

InChI

InChI=1S/C7H8N2O4/c1-3(2)9-6(11)5(10)4(8-9)7(12)13/h3H,1-2H3,(H,12,13)