(1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) 4-methylbenzenesulfonate Openeye Name: (1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) ester IUPAC Name: (1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1,5-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl) ester Formula: C16H20O4S MolecularWeight: 308.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC3(C=CC(C2)(O3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC3(C=CC(C2)(O3)C)C

InChI

InChI=1S/C16H20O4S/c1-12-4-6-14(7-5-12)21(17,18)19-13-10-15(2)8-9-16(3,11-13)20-15/h4-9,13H,10-11H2,1-3H3