2-[1-(4,6-dimethylpyrimidin-2-yl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-oxo-4H-pyrazol-3-yl]acetic acid CAS Name: 2-[1-(4,6-dimethyl-2-pyrimidinyl)-5-oxo-4H-pyrazol-3-yl]acetic acid IUPAC Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-oxo-4H-pyrazol-3-yl]acetic acid Traditional Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-keto-2-pyrazolin-3-yl]acetic acid Formula: C11H12N4O3 MolecularWeight: 248.23798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=O)CC(=N2)CC(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=O)CC(=N2)CC(=O)O)C

InChI

InChI=1S/C11H12N4O3/c1-6-3-7(2)13-11(12-6)15-9(16)4-8(14-15)5-10(17)18/h3H,4-5H2,1-2H3,(H,17,18)