4-bromanyl-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-bromanyl-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 4-bromo-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 4-bromo-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-bromo-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 4-bromo-1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid Formula: C17H11BrCl2N2O3 MolecularWeight: 442.09084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Br

InChI

InChI=1S/C17H11BrCl2N2O3/c1-25-11-5-2-9(3-6-11)16-14(18)15(17(23)24)21-22(16)13-7-4-10(19)8-12(13)20/h2-8H,1H3,(H,23,24)