2,4-bis(chloranyl)-5-(3,5-dimethylpyrazol-1-yl)sulfonyl-benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-(3,5-dimethylpyrazol-1-yl)sulfonyl-benzoic acid Openeye Name: 2,4-dichloro-5-(3,5-dimethylpyrazol-1-yl)sulfonyl-benzoic acid CAS Name: 2,4-dichloro-5-[(3,5-dimethyl-1-pyrazolyl)sulfonyl]benzoic acid IUPAC Name: 2,4-dichloro-5-(3,5-dimethylpyrazol-1-yl)sulfonylbenzoic acid Traditional Name: 2,4-dichloro-5-(3,5-dimethylpyrazol-1-yl)sulfonyl-benzoic acid Formula: C12H10Cl2N2O4S MolecularWeight: 349.1898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl)C

InChI

InChI=1S/C12H10Cl2N2O4S/c1-6-3-7(2)16(15-6)21(19,20)11-4-8(12(17)18)9(13)5-10(11)14/h3-5H,1-2H3,(H,17,18)