methyl 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxylate Openeye Name: methyl 4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxylate CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxylate Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxylic acid methyl ester Formula: C12H9BrClN3O3 MolecularWeight: 358.57516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

Isomeric SMILES

COC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

InChI

InChI=1S/C12H9BrClN3O3/c1-20-12(19)9-8(13)10(17-16-9)15-11(18)6-4-2-3-5-7(6)14/h2-5H,1H3,(H2,15,16,17,18)