methyl 4-chloranyl-3-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]benzoate Openeye Name: methyl 4-chloro-3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]benzoic acid methyl ester Formula: C12H16ClNO5S MolecularWeight: 321.77714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO5S/c1-12(2,7-15)14-20(17,18)10-6-8(11(16)19-3)4-5-9(10)13/h4-6,14-15H,7H2,1-3H3