methanediol; 2,3,4,5-tetrakis(oxidanyl)hexyl 4-methylbenzenesulfonate

Systemtic Name: methanediol; 2,3,4,5-tetrakis(oxidanyl)hexyl 4-methylbenzenesulfonate Openeye Name: methanediol; 2,3,4,5-tetrahydroxyhexyl 4-methylbenzenesulfonate CAS Name: methanediol; 4-methylbenzenesulfonic acid 2,3,4,5-tetrahydroxyhexyl ester IUPAC Name: methanediol; 2,3,4,5-tetrahydroxyhexyl 4-methylbenzenesulfonate Traditional Name: methanediol; 4-methylbenzenesulfonic acid 2,3,4,5-tetrahydroxyhexyl ester Formula: C14H24O9S MolecularWeight: 368.39996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C(C(C)O)O)O)O.C(O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C(C(C)O)O)O)O.C(O)O

InChI

InChI=1S/C13H20O7S.CH4O2/c1-8-3-5-10(6-4-8)21(18,19)20-7-11(15)13(17)12(16)9(2)14;2-1-3/h3-6,9,11-17H,7H2,1-2H3;2-3H,1H2