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

Systemtic Name: methyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxidanylidene-1H-pyrazol-5-yl]ethanoate Openeye Name: methyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxo-1H-pyrazol-5-yl]acetate CAS Name: 2-[2-(4,6-dimethyl-2-pyrimidinyl)-3-oxo-1H-pyrazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-3-oxo-1H-pyrazol-5-yl]acetate Traditional Name: 2-[1-(4,6-dimethylpyrimidin-2-yl)-5-keto-3-pyrazolin-3-yl]acetic acid methyl ester Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O3/c1-7-4-8(2)14-12(13-7)16-10(17)5-9(15-16)6-11(18)19-3/h4-5,15H,6H2,1-3H3