4-octoxypentyl 4-methylbenzenesulfonate

Systemtic Name: 4-octoxypentyl 4-methylbenzenesulfonate Openeye Name: 4-octoxypentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-octoxypentyl ester IUPAC Name: 4-octoxypentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-octoxypentyl ester Formula: C20H34O4S MolecularWeight: 370.54656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)CCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCOC(C)CCCOS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C20H34O4S/c1-4-5-6-7-8-9-16-23-19(3)11-10-17-24-25(21,22)20-14-12-18(2)13-15-20/h12-15,19H,4-11,16-17H2,1-3H3