[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-methyl-5-sulfamoyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-methyl-5-sulfamoyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-methyl-5-sulfamoyl-benzoate CAS Name: 2-methyl-5-sulfamoylbenzoic acid [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-methyl-5-sulfamoylbenzoate Traditional Name: 2-methyl-5-sulfamoyl-benzoic acid [2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OC(C)C(=O)C2=CC(=C(C=C2C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OC(C)C(=O)C2=CC(=C(C=C2C)C)C

InChI

InChI=1S/C20H23NO5S/c1-11-6-7-16(27(21,24)25)10-18(11)20(23)26-15(5)19(22)17-9-13(3)12(2)8-14(17)4/h6-10,15H,1-5H3,(H2,21,24,25)