(5-methoxy-2-oxidanyl-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (5-methoxy-2-oxidanyl-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (2-hydroxy-5-methoxy-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-hydroxy-5-methoxy-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl ester IUPAC Name: (2-hydroxy-5-methoxy-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-hydroxy-5-methoxy-4,7-dioxabicyclo[4.1.0]heptan-3-yl)methyl ester Formula: C14H18O7S MolecularWeight: 330.35352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C3C(O3)C(O2)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C3C(O3)C(O2)OC)O

InChI

InChI=1S/C14H18O7S/c1-8-3-5-9(6-4-8)22(16,17)19-7-10-11(15)12-13(21-12)14(18-2)20-10/h3-6,10-15H,7H2,1-2H3