[(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester IUPAC Name: [(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R)-5-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester Formula: C17H18O6S MolecularWeight: 350.38622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=C(O2)C(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2COC3=C(O2)C(=CC=C3)OC

InChI

InChI=1S/C17H18O6S/c1-12-6-8-14(9-7-12)24(18,19)22-11-13-10-21-16-5-3-4-15(20-2)17(16)23-13/h3-9,13H,10-11H2,1-2H3/t13-/m1/s1