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

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoate Traditional Name: 2-methyl-5-[methyl(p-phenetyl)sulfamoyl]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C23H29NO6S/c1-7-29-18-11-9-17(10-12-18)24(6)31(27,28)19-13-8-16(2)20(14-19)22(26)30-15-21(25)23(3,4)5/h8-14H,7,15H2,1-6H3