(4-hexoxyphenyl) 4-propan-2-ylbenzenesulfonate

Systemtic Name: (4-hexoxyphenyl) 4-propan-2-ylbenzenesulfonate Openeye Name: (4-hexoxyphenyl) 4-isopropylbenzenesulfonate CAS Name: 4-propan-2-ylbenzenesulfonic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 4-propan-2-ylbenzenesulfonate Traditional Name: 4-isopropylbenzenesulfonic acid (4-hexoxyphenyl) ester Formula: C21H28O4S MolecularWeight: 376.50962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O4S/c1-4-5-6-7-16-24-19-10-12-20(13-11-19)25-26(22,23)21-14-8-18(9-15-21)17(2)3/h8-15,17H,4-7,16H2,1-3H3