[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(cyclopropylsulfamoyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(cyclopropylsulfamoyl)benzoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(cyclopropylsulfamoyl)benzoate CAS Name: 3-(cyclopropylsulfamoyl)benzoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(cyclopropylsulfamoyl)benzoate Traditional Name: 3-(cyclopropylsulfamoyl)benzoic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CC3)C)C

InChI

InChI=1S/C21H23NO5S/c1-13-9-15(3)19(10-14(13)2)20(23)12-27-21(24)16-5-4-6-18(11-16)28(25,26)22-17-7-8-17/h4-6,9-11,17,22H,7-8,12H2,1-3H3