[(2S)-1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 4-methoxy-3-(methylsulfamoyl)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 4-methoxy-3-(methylsulfamoyl)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 4-methoxy-3-(methylsulfamoyl)benzoate CAS Name: 4-methoxy-3-(methylsulfamoyl)benzoic acid [(2S)-1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 4-methoxy-3-(methylsulfamoyl)benzoate Traditional Name: 4-methoxy-3-(methylsulfamoyl)benzoic acid [(1S)-2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)[C@H](C)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC)C)C

InChI

InChI=1S/C21H25NO6S/c1-12-9-14(3)17(10-13(12)2)20(23)15(4)28-21(24)16-7-8-18(27-6)19(11-16)29(25,26)22-5/h7-11,15,22H,1-6H3/t15-/m0/s1