[(E)-1-(2,4-dichlorophenyl)ethylideneamino] 4-bromanyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [(E)-1-(2,4-dichlorophenyl)ethylideneamino] 4-bromanyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [(E)-1-(2,4-dichlorophenyl)ethylideneamino] 4-bromo-1-methyl-pyrazole-3-carboxylate CAS Name: 4-bromo-1-methyl-3-pyrazolecarboxylic acid [(E)-1-(2,4-dichlorophenyl)ethylideneamino] ester IUPAC Name: [(E)-1-(2,4-dichlorophenyl)ethylideneamino] 4-bromo-1-methylpyrazole-3-carboxylate Traditional Name: 4-bromo-1-methyl-pyrazole-3-carboxylic acid [(E)-1-(2,4-dichlorophenyl)ethylideneamino] ester Formula: C13H10BrCl2N3O2 MolecularWeight: 391.0474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrCl2N3O2/c1-7(9-4-3-8(15)5-11(9)16)18-21-13(20)12-10(14)6-19(2)17-12/h3-6H,1-2H3/b18-7+