(3,3-dimethyl-2-oxidanylidene-butyl) 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-ethoxyphenyl)sulfamoyl]-2-methylbenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 5-[(4-ethoxyphenyl)sulfamoyl]-2-methylbenzoate Traditional Name: 2-methyl-5-(p-phenetylsulfamoyl)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C22H27NO6S/c1-6-28-17-10-8-16(9-11-17)23-30(26,27)18-12-7-15(2)19(13-18)21(25)29-14-20(24)22(3,4)5/h7-13,23H,6,14H2,1-5H3