[(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]tetrahydrofuran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-oxolanyl] ester IUPAC Name: [(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]oxolan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R,4R)-4-veratryltetrahydrofuran-3-yl] ester Formula: C20H24O6S MolecularWeight: 392.46596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2COCC2CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2COC[C@H]2CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24O6S/c1-14-4-7-17(8-5-14)27(21,22)26-20-13-25-12-16(20)10-15-6-9-18(23-2)19(11-15)24-3/h4-9,11,16,20H,10,12-13H2,1-3H3/t16-,20+/m1/s1