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

Systemtic Name: 5-chloranyl-2-methoxy-3-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]benzoic acid Openeye Name: 5-chloro-3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-2-methoxy-benzoic acid CAS Name: 5-chloro-3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-2-methoxybenzoic acid IUPAC Name: 5-chloro-3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-2-methoxybenzoic acid Traditional Name: 5-chloro-3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-2-methoxy-benzoic acid Formula: C12H16ClNO6S MolecularWeight: 337.77654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NS(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)OC

Isomeric SMILES

CC(C)(CO)NS(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)OC

InChI

InChI=1S/C12H16ClNO6S/c1-12(2,6-15)14-21(18,19)9-5-7(13)4-8(11(16)17)10(9)20-3/h4-5,14-15H,6H2,1-3H3,(H,16,17)