methyl 1-(5-bromanylpyridin-2-yl)-5-(2-chlorophenyl)pyrazole-4-carboxylate

Systemtic Name: methyl 1-(5-bromanylpyridin-2-yl)-5-(2-chlorophenyl)pyrazole-4-carboxylate Openeye Name: methyl 1-(5-bromo-2-pyridyl)-5-(2-chlorophenyl)pyrazole-4-carboxylate CAS Name: 1-(5-bromo-2-pyridinyl)-5-(2-chlorophenyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-bromopyridin-2-yl)-5-(2-chlorophenyl)pyrazole-4-carboxylate Traditional Name: 1-(5-bromo-2-pyridyl)-5-(2-chlorophenyl)pyrazole-4-carboxylic acid methyl ester Formula: C16H11BrClN3O2 MolecularWeight: 392.63444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=NC=C(C=C2)Br)C3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=NC=C(C=C2)Br)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H11BrClN3O2/c1-23-16(22)12-9-20-21(14-7-6-10(17)8-19-14)15(12)11-4-2-3-5-13(11)18/h2-9H,1H3