2-bromanyl-5-methylsulfonyl-4-pyridin-3-yloxy-benzoic acid

Systemtic Name: 2-bromanyl-5-methylsulfonyl-4-pyridin-3-yloxy-benzoic acid Openeye Name: 2-bromo-5-methylsulfonyl-4-(3-pyridyloxy)benzoic acid CAS Name: 2-bromo-5-methylsulfonyl-4-(3-pyridinyloxy)benzoic acid IUPAC Name: 2-bromo-5-methylsulfonyl-4-pyridin-3-yloxybenzoic acid Traditional Name: 2-bromo-5-mesyl-4-(3-pyridyloxy)benzoic acid Formula: C13H10BrNO5S MolecularWeight: 372.1912

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)Br)OC2=CN=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)Br)OC2=CN=CC=C2

InChI

InChI=1S/C13H10BrNO5S/c1-21(18,19)12-5-9(13(16)17)10(14)6-11(12)20-8-3-2-4-15-7-8/h2-7H,1H3,(H,16,17)