3-fluoranyl-4-methyl-5-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]benzoic acid Openeye Name: 3-fluoro-5-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-fluoro-5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-fluoro-5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-fluoro-5-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-4-methyl-benzoic acid Formula: C12H16FNO5S MolecularWeight: 305.322543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)NC(C)(C)CO)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)NC(C)(C)CO)C(=O)O)F

InChI

InChI=1S/C12H16FNO5S/c1-7-9(13)4-8(11(16)17)5-10(7)20(18,19)14-12(2,3)6-15/h4-5,14-15H,6H2,1-3H3,(H,16,17)