3-oxidanylidenebutan-2-yl 4-(oxolan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Openeye Name: (1-methyl-2-oxo-propyl) 4-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoate CAS Name: 4-(2-oxolanylmethylsulfamoyl)benzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(tetrahydrofurfurylsulfamoyl)benzoic acid (2-keto-1-methyl-propyl) ester Formula: C16H21NO6S MolecularWeight: 355.40604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2CCCO2

Isomeric SMILES

CC(C(=O)C)OC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2CCCO2

InChI

InChI=1S/C16H21NO6S/c1-11(18)12(2)23-16(19)13-5-7-15(8-6-13)24(20,21)17-10-14-4-3-9-22-14/h5-8,12,14,17H,3-4,9-10H2,1-2H3