(3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-5-[(2-methoxyphenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-5-[(2-methoxyphenyl)-methyl-sulfamoyl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-chloro-5-[(2-methoxyphenyl)-methyl-sulfamoyl]benzoate CAS Name: 2-chloro-5-[(2-methoxyphenyl)-methylsulfamoyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-chloro-5-[(2-methoxyphenyl)-methylsulfamoyl]benzoate Traditional Name: 2-chloro-5-[(2-methoxyphenyl)-methyl-sulfamoyl]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H24ClNO6S MolecularWeight: 453.93636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=CC=C2OC)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=CC=C2OC)Cl

InChI

InChI=1S/C21H24ClNO6S/c1-21(2,3)19(24)13-29-20(25)15-12-14(10-11-16(15)22)30(26,27)23(4)17-8-6-7-9-18(17)28-5/h6-12H,13H2,1-5H3