(3,3-dimethyl-2-oxidanylidene-butyl) 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-hydroxy-4-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-4-(2-thienylsulfonylamino)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H19NO6S2 MolecularWeight: 397.46586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CS2)O

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CS2)O

InChI

InChI=1S/C17H19NO6S2/c1-17(2,3)14(20)10-24-16(21)12-7-6-11(9-13(12)19)18-26(22,23)15-5-4-8-25-15/h4-9,18-19H,10H2,1-3H3