(2-oxidanylidene-1,3-benzoxathiol-5-yl) 4-tert-butylbenzenesulfonate

Systemtic Name: (2-oxidanylidene-1,3-benzoxathiol-5-yl) 4-tert-butylbenzenesulfonate Openeye Name: (2-oxo-1,3-benzoxathiol-5-yl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (2-oxo-1,3-benzoxathiol-5-yl) ester IUPAC Name: (2-oxo-1,3-benzoxathiol-5-yl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2-keto-1,3-benzoxathiol-5-yl) ester Formula: C17H16O5S2 MolecularWeight: 364.43594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC(=O)S3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC(=O)S3

InChI

InChI=1S/C17H16O5S2/c1-17(2,3)11-4-7-13(8-5-11)24(19,20)22-12-6-9-14-15(10-12)23-16(18)21-14/h4-10H,1-3H3