(2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl ester IUPAC Name: (2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2,3-dimethyl-2H-1,4-benzodioxin-3-yl)methyl ester Formula: C18H20O5S MolecularWeight: 348.4134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)(C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)(C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H20O5S/c1-13-8-10-15(11-9-13)24(19,20)21-12-18(3)14(2)22-16-6-4-5-7-17(16)23-18/h4-11,14H,12H2,1-3H3