4-bromanyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]benzoic acid

Systemtic Name: 4-bromanyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]benzoic acid Openeye Name: 4-bromo-3-[(5-methylisoxazol-3-yl)methylsulfonyl]benzoic acid CAS Name: 4-bromo-3-[(5-methyl-3-isoxazolyl)methylsulfonyl]benzoic acid IUPAC Name: 4-bromo-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]benzoic acid Traditional Name: 4-bromo-3-[(5-methylisoxazol-3-yl)methylsulfonyl]benzoic acid Formula: C12H10BrNO5S MolecularWeight: 360.1805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C12H10BrNO5S/c1-7-4-9(14-19-7)6-20(17,18)11-5-8(12(15)16)2-3-10(11)13/h2-5H,6H2,1H3,(H,15,16)