2-(4,6-dimethylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-oxo-1H-pyrazole-5-carboxylic acid CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-4-(2-hydroxyethyl)-3-oxo-1H-pyrazole-5-carboxylic acid IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-4-(2-hydroxyethyl)-3-oxo-1H-pyrazole-5-carboxylic acid Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-(2-hydroxyethyl)-5-keto-3-pyrazoline-3-carboxylic acid Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4/c1-6-5-7(2)14-12(13-6)16-10(18)8(3-4-17)9(15-16)11(19)20/h5,15,17H,3-4H2,1-2H3,(H,19,20)