(6-methoxy-3-oxidanyl-4-phenylmethoxy-oxan-2-yl)methyl 4-methylbenzenesulfonate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(CC(O2)OC)OCC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(CC(O2)OC)OCC3=CC=CC=C3)O

InChI

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