[(E)-1-pyridin-2-ylethylideneamino] 4-bromanyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [(E)-1-pyridin-2-ylethylideneamino] 4-bromanyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [(E)-1-(2-pyridyl)ethylideneamino] 4-bromo-1-methyl-pyrazole-3-carboxylate CAS Name: 4-bromo-1-methyl-3-pyrazolecarboxylic acid [(E)-1-(2-pyridinyl)ethylideneamino] ester IUPAC Name: [(E)-1-pyridin-2-ylethylideneamino] 4-bromo-1-methylpyrazole-3-carboxylate Traditional Name: 4-bromo-1-methyl-pyrazole-3-carboxylic acid [(E)-1-(2-pyridyl)ethylideneamino] ester Formula: C12H11BrN4O2 MolecularWeight: 323.14534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=NN(C=C1Br)C)C2=CC=CC=N2

Isomeric SMILES

C/C(=N\OC(=O)C1=NN(C=C1Br)C)/C2=CC=CC=N2

InChI

InChI=1S/C12H11BrN4O2/c1-8(10-5-3-4-6-14-10)16-19-12(18)11-9(13)7-17(2)15-11/h3-7H,1-2H3/b16-8+