4,4-dimethoxybutyl 4-methylbenzenesulfonate

Systemtic Name: 4,4-dimethoxybutyl 4-methylbenzenesulfonate Openeye Name: 4,4-dimethoxybutyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4,4-dimethoxybutyl ester IUPAC Name: 4,4-dimethoxybutyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4,4-dimethoxybutyl ester Formula: C13H20O5S MolecularWeight: 288.3599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(OC)OC

InChI

InChI=1S/C13H20O5S/c1-11-6-8-12(9-7-11)19(14,15)18-10-4-5-13(16-2)17-3/h6-9,13H,4-5,10H2,1-3H3