(3,3-dimethyl-2-oxidanylidene-butyl) 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 3-[(3-chlorophenyl)-methylsulfamoyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[(3-chlorophenyl)-methylsulfamoyl]benzoate Traditional Name: 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO5S/c1-20(2,3)18(23)13-27-19(24)14-7-5-10-17(11-14)28(25,26)22(4)16-9-6-8-15(21)12-16/h5-12H,13H2,1-4H3