2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl ester IUPAC Name: 2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl ester Formula: C25H36O5S MolecularWeight: 448.61534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C25H36O5S/c1-20-7-13-23(14-8-20)31(26,27)30-18-16-28-15-17-29-22-11-9-21(10-12-22)25(5,6)19-24(2,3)4/h7-14H,15-19H2,1-6H3