3-methylsulfonyl-4-pyrazol-1-yl-benzoic acid

Systemtic Name: 3-methylsulfonyl-4-pyrazol-1-yl-benzoic acid Openeye Name: 3-methylsulfonyl-4-pyrazol-1-yl-benzoic acid CAS Name: 3-methylsulfonyl-4-(1-pyrazolyl)benzoic acid IUPAC Name: 3-methylsulfonyl-4-pyrazol-1-ylbenzoic acid Traditional Name: 3-mesyl-4-pyrazol-1-yl-benzoic acid Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2C=CC=N2

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2C=CC=N2

InChI

InChI=1S/C11H10N2O4S/c1-18(16,17)10-7-8(11(14)15)3-4-9(10)13-6-2-5-12-13/h2-7H,1H3,(H,14,15)