[(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(diethylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(diethylsulfamoyl)benzoate Openeye Name: [(1R)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] 3-(diethylsulfamoyl)benzoate CAS Name: 3-(diethylsulfamoyl)benzoic acid [(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] 3-(diethylsulfamoyl)benzoate Traditional Name: 3-(diethylsulfamoyl)benzoic acid [(1R)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OC(C)C(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)O[C@H](C)C(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C22H27NO5S/c1-6-23(7-2)29(26,27)19-10-8-9-18(14-19)22(25)28-17(5)21(24)20-13-15(3)11-12-16(20)4/h8-14,17H,6-7H2,1-5H3/t17-/m1/s1