methyl 3-azanyl-5-[4-bromanyl-2,6-bis(chloranyl)phenyl]-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 3-azanyl-5-[4-bromanyl-2,6-bis(chloranyl)phenyl]-1H-pyrazole-4-carboxylate Openeye Name: methyl 3-amino-5-(4-bromo-2,6-dichloro-phenyl)-1H-pyrazole-4-carboxylate CAS Name: 3-amino-5-(4-bromo-2,6-dichlorophenyl)-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-(4-bromo-2,6-dichlorophenyl)-1H-pyrazole-4-carboxylate Traditional Name: 3-amino-5-(4-bromo-2,6-dichloro-phenyl)-1H-pyrazole-4-carboxylic acid methyl ester Formula: C11H8BrCl2N3O2 MolecularWeight: 365.01012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NN=C1N)C2=C(C=C(C=C2Cl)Br)Cl

Isomeric SMILES

COC(=O)C1=C(NN=C1N)C2=C(C=C(C=C2Cl)Br)Cl

InChI

InChI=1S/C11H8BrCl2N3O2/c1-19-11(18)8-9(16-17-10(8)15)7-5(13)2-4(12)3-6(7)14/h2-3H,1H3,(H3,15,16,17)