[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-methylpyrazole-3-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-methylpyrazole-3-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-methylpyrazole-3-carboxylate CAS Name: 2-methyl-3-pyrazolecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-methylpyrazole-3-carboxylate Traditional Name: 2-methylpyrazole-3-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C13H11BrN2O3 MolecularWeight: 323.14204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN1C(=CC=N1)C(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H11BrN2O3/c1-16-11(6-7-15-16)13(18)19-8-12(17)9-2-4-10(14)5-3-9/h2-7H,8H2,1H3