phenyl 4-bromanyl-3,5-dimethyl-pyrazole-1-carboxylate

Systemtic Name: phenyl 4-bromanyl-3,5-dimethyl-pyrazole-1-carboxylate Openeye Name: phenyl 4-bromo-3,5-dimethyl-pyrazole-1-carboxylate CAS Name: 4-bromo-3,5-dimethyl-1-pyrazolecarboxylic acid phenyl ester IUPAC Name: phenyl 4-bromo-3,5-dimethylpyrazole-1-carboxylate Traditional Name: 4-bromo-3,5-dimethyl-pyrazole-1-carboxylic acid phenyl ester Formula: C12H11BrN2O2 MolecularWeight: 295.13194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)OC2=CC=CC=C2)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)OC2=CC=CC=C2)C)Br

InChI

InChI=1S/C12H11BrN2O2/c1-8-11(13)9(2)15(14-8)12(16)17-10-6-4-3-5-7-10/h3-7H,1-2H3