3-oxidanylidenebutan-2-yl 2-methyl-5-sulfamoyl-benzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 2-methyl-5-sulfamoyl-benzoate Openeye Name: (1-methyl-2-oxo-propyl) 2-methyl-5-sulfamoyl-benzoate CAS Name: 2-methyl-5-sulfamoylbenzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 2-methyl-5-sulfamoylbenzoate Traditional Name: 2-methyl-5-sulfamoyl-benzoic acid (2-keto-1-methyl-propyl) ester Formula: C12H15NO5S MolecularWeight: 285.3162

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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)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OC(C)C(=O)C

InChI

InChI=1S/C12H15NO5S/c1-7-4-5-10(19(13,16)17)6-11(7)12(15)18-9(3)8(2)14/h4-6,9H,1-3H3,(H2,13,16,17)