(E)-4-[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl]oxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl]oxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl]oxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[2-(4,6-dimethyl-2-pyrimidinyl)-4-ethyl-5-methyl-3-pyrazolyl]oxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methylpyrazol-3-yl]oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl]oxy-4-keto-but-2-enoic acid Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OC(=O)C=CC(=O)O

Isomeric SMILES

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H18N4O4/c1-5-12-11(4)19-20(16-17-9(2)8-10(3)18-16)15(12)24-14(23)7-6-13(21)22/h6-8H,5H2,1-4H3,(H,21,22)/b7-6+