[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl 4-methylbenzenesulfonate

Systemtic Name: [5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl 4-methylbenzenesulfonate Openeye Name: [3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxymethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]oxymethyl ester IUPAC Name: [3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)oxymethyl ester Formula: C13H18O8S MolecularWeight: 334.34222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCOC2C(C(C(O2)CO)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCOC2C(C(C(O2)CO)O)O

InChI

InChI=1S/C13H18O8S/c1-8-2-4-9(5-3-8)22(17,18)20-7-19-13-12(16)11(15)10(6-14)21-13/h2-5,10-16H,6-7H2,1H3