7-oxabicyclo[2.2.1]heptan-3-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 7-oxabicyclo[2.2.1]heptan-3-ylmethyl 4-methylbenzenesulfonate Openeye Name: 7-oxabicyclo[2.2.1]heptan-3-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 7-oxabicyclo[2.2.1]heptan-3-ylmethyl ester IUPAC Name: 7-oxabicyclo[2.2.1]heptan-3-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 7-oxabicyclo[2.2.1]heptan-3-ylmethyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3CCC2O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3CCC2O3

InChI

InChI=1S/C14H18O4S/c1-10-2-5-13(6-3-10)19(15,16)17-9-11-8-12-4-7-14(11)18-12/h2-3,5-6,11-12,14H,4,7-9H2,1H3