[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 4-chloro-1-methyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1-methyl-3-pyrazolecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 4-chloro-1-methylpyrazole-3-carboxylate Traditional Name: 4-chloro-1-methyl-pyrazole-3-carboxylic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C14H13ClN2O4 MolecularWeight: 308.71702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OCC(=O)C2=CC=C(C=C2)OC)Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OCC(=O)C2=CC=C(C=C2)OC)Cl

InChI

InChI=1S/C14H13ClN2O4/c1-17-7-11(15)13(16-17)14(19)21-8-12(18)9-3-5-10(20-2)6-4-9/h3-7H,8H2,1-2H3