(4-hexoxyphenyl) 2,5-diethylbenzenesulfonate

Systemtic Name: (4-hexoxyphenyl) 2,5-diethylbenzenesulfonate Openeye Name: (4-hexoxyphenyl) 2,5-diethylbenzenesulfonate CAS Name: 2,5-diethylbenzenesulfonic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 2,5-diethylbenzenesulfonate Traditional Name: 2,5-diethylbenzenesulfonic acid (4-hexoxyphenyl) ester Formula: C22H30O4S MolecularWeight: 390.5362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)CC)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)CC)CC

InChI

InChI=1S/C22H30O4S/c1-4-7-8-9-16-25-20-12-14-21(15-13-20)26-27(23,24)22-17-18(5-2)10-11-19(22)6-3/h10-15,17H,4-9,16H2,1-3H3