9-(oxan-2-yloxy)nonyl 4-methylbenzenesulfonate

Systemtic Name: 9-(oxan-2-yloxy)nonyl 4-methylbenzenesulfonate Openeye Name: 9-tetrahydropyran-2-yloxynonyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 9-(2-oxanyloxy)nonyl ester IUPAC Name: 9-(oxan-2-yloxy)nonyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 9-tetrahydropyran-2-yloxynonyl ester Formula: C21H34O5S MolecularWeight: 398.55666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCOC2CCCCO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCOC2CCCCO2

InChI

InChI=1S/C21H34O5S/c1-19-12-14-20(15-13-19)27(22,23)26-18-9-6-4-2-3-5-8-16-24-21-11-7-10-17-25-21/h12-15,21H,2-11,16-18H2,1H3