(2-propan-2-yl-1,3-dioxan-5-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (2-propan-2-yl-1,3-dioxan-5-yl)methyl 4-methylbenzenesulfonate Openeye Name: (2-isopropyl-1,3-dioxan-5-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-propan-2-yl-1,3-dioxan-5-yl)methyl ester IUPAC Name: (2-propan-2-yl-1,3-dioxan-5-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-isopropyl-1,3-dioxan-5-yl)methyl ester Formula: C15H22O5S MolecularWeight: 314.39718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC(OC2)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC(OC2)C(C)C

InChI

InChI=1S/C15H22O5S/c1-11(2)15-18-8-13(9-19-15)10-20-21(16,17)14-6-4-12(3)5-7-14/h4-7,11,13,15H,8-10H2,1-3H3