(3,3-dimethyl-2-oxidanylidene-butyl) 3-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfamoyl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfamoyl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[(5-chloro-2,4-dimethoxy-phenyl)sulfamoyl]benzoate CAS Name: 3-[(5-chloro-2,4-dimethoxyphenyl)sulfamoyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[(5-chloro-2,4-dimethoxyphenyl)sulfamoyl]benzoate Traditional Name: 3-[(5-chloro-2,4-dimethoxy-phenyl)sulfamoyl]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H24ClNO7S MolecularWeight: 469.93576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2OC)OC)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2OC)OC)Cl

InChI

InChI=1S/C21H24ClNO7S/c1-21(2,3)19(24)12-30-20(25)13-7-6-8-14(9-13)31(26,27)23-16-10-15(22)17(28-4)11-18(16)29-5/h6-11,23H,12H2,1-5H3