[3-(1-ethoxyethoxy)-4,4,4-tris(fluoranyl)butyl] 4-methylbenzenesulfonate

Systemtic Name: [3-(1-ethoxyethoxy)-4,4,4-tris(fluoranyl)butyl] 4-methylbenzenesulfonate Openeye Name: [3-(1-ethoxyethoxy)-4,4,4-trifluoro-butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(1-ethoxyethoxy)-4,4,4-trifluorobutyl] ester IUPAC Name: [3-(1-ethoxyethoxy)-4,4,4-trifluorobutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(1-ethoxyethoxy)-4,4,4-trifluoro-butyl] ester Formula: C15H21F3O5S MolecularWeight: 370.38445

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OC(CCOS(=O)(=O)C1=CC=C(C=C1)C)C(F)(F)F

Isomeric SMILES

CCOC(C)OC(CCOS(=O)(=O)C1=CC=C(C=C1)C)C(F)(F)F

InChI

InChI=1S/C15H21F3O5S/c1-4-21-12(3)23-14(15(16,17)18)9-10-22-24(19,20)13-7-5-11(2)6-8-13/h5-8,12,14H,4,9-10H2,1-3H3