[2-(propan-2-yloxycarbonyloxymethyl)-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [2-(propan-2-yloxycarbonyloxymethyl)-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl 4-methylbenzenesulfonate Openeye Name: [2-(isopropoxycarbonyloxymethyl)-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[[oxo(propan-2-yloxy)methoxy]methyl]-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl ester IUPAC Name: [2-(propan-2-yloxycarbonyloxymethyl)-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(isopropoxycarbonyloxymethyl)-7-oxabicyclo[2.2.1]hept-3-en-3-yl]methyl ester Formula: C19H24O7S MolecularWeight: 396.45466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C3CCC(C2COC(=O)OC(C)C)O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C3CCC(C2COC(=O)OC(C)C)O3

InChI

InChI=1S/C19H24O7S/c1-12(2)25-19(20)23-10-15-16(18-9-8-17(15)26-18)11-24-27(21,22)14-6-4-13(3)5-7-14/h4-7,12,15,17H,8-11H2,1-3H3