5-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-chloranyl-benzoic acid

Systemtic Name: 5-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-chloranyl-benzoic acid Openeye Name: 5-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-chloro-benzoic acid CAS Name: 5-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-chlorobenzoic acid IUPAC Name: 5-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-chlorobenzoic acid Traditional Name: 5-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-chloro-benzoic acid Formula: C12H10BrClN2O2 MolecularWeight: 329.577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=C(C=C2)Cl)C(=O)O)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=C(C=C2)Cl)C(=O)O)C)Br

InChI

InChI=1S/C12H10BrClN2O2/c1-6-11(13)7(2)16(15-6)8-3-4-10(14)9(5-8)12(17)18/h3-5H,1-2H3,(H,17,18)