2-bromanyl-5-[methyl(oxan-4-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-bromanyl-5-[methyl(oxan-4-yl)sulfamoyl]benzoic acid Openeye Name: 2-bromo-5-[methyl(tetrahydropyran-4-yl)sulfamoyl]benzoic acid CAS Name: 2-bromo-5-[methyl(4-oxanyl)sulfamoyl]benzoic acid IUPAC Name: 2-bromo-5-[methyl(oxan-4-yl)sulfamoyl]benzoic acid Traditional Name: 2-bromo-5-[methyl(tetrahydropyran-4-yl)sulfamoyl]benzoic acid Formula: C13H16BrNO5S MolecularWeight: 378.23884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

CN(C1CCOCC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C13H16BrNO5S/c1-15(9-4-6-20-7-5-9)21(18,19)10-2-3-12(14)11(8-10)13(16)17/h2-3,8-9H,4-7H2,1H3,(H,16,17)