[2-(hydroxymethyl)-6-methoxy-4-phenylmethoxy-oxan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [2-(hydroxymethyl)-6-methoxy-4-phenylmethoxy-oxan-3-yl] 4-methylbenzenesulfonate Openeye Name: [4-benzyloxy-2-(hydroxymethyl)-6-methoxy-tetrahydropyran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(hydroxymethyl)-6-methoxy-4-phenylmethoxy-3-oxanyl] ester IUPAC Name: [2-(hydroxymethyl)-6-methoxy-4-phenylmethoxyoxan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-benzoxy-6-methoxy-2-methylol-tetrahydropyran-3-yl) ester Formula: C21H26O7S MolecularWeight: 422.49194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(CC(OC2CO)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2C(CC(OC2CO)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26O7S/c1-15-8-10-17(11-9-15)29(23,24)28-21-18(12-20(25-2)27-19(21)13-22)26-14-16-6-4-3-5-7-16/h3-11,18-22H,12-14H2,1-2H3