methyl 4-bromanyl-3-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 4-bromanyl-3-phenyl-1H-pyrazole-5-carboxylate Openeye Name: methyl 4-bromo-3-phenyl-1H-pyrazole-5-carboxylate CAS Name: 4-bromo-3-phenyl-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-bromo-3-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 4-bromo-3-phenyl-1H-pyrazole-5-carboxylic acid methyl ester Formula: C11H9BrN2O2 MolecularWeight: 281.10536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NN1)C2=CC=CC=C2)Br

Isomeric SMILES

COC(=O)C1=C(C(=NN1)C2=CC=CC=C2)Br

InChI

InChI=1S/C11H9BrN2O2/c1-16-11(15)10-8(12)9(13-14-10)7-5-3-2-4-6-7/h2-6H,1H3,(H,13,14)