[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxylate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxylate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 3-chloro-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxylate CAS Name: 3-chloro-6-(3,5-dimethyl-1-pyrazolyl)-2-pyridinecarboxylic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 3-chloro-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxylate Traditional Name: 3-chloro-6-(3,5-dimethylpyrazol-1-yl)picolinic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H18BrClN4O3 MolecularWeight: 477.73892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=N2)N3C(=CC(=N3)C)C)Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=N2)N3C(=CC(=N3)C)C)Cl)Br

InChI

InChI=1S/C20H18BrClN4O3/c1-11-4-6-16(14(21)8-11)23-18(27)10-29-20(28)19-15(22)5-7-17(24-19)26-13(3)9-12(2)25-26/h4-9H,10H2,1-3H3,(H,23,27)