4-propoxybutyl 4-methylbenzenesulfonate

Systemtic Name: 4-propoxybutyl 4-methylbenzenesulfonate Openeye Name: 4-propoxybutyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-propoxybutyl ester IUPAC Name: 4-propoxybutyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-propoxybutyl ester Formula: C14H22O4S MolecularWeight: 286.38708

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCOCCCCOS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H22O4S/c1-3-10-17-11-4-5-12-18-19(15,16)14-8-6-13(2)7-9-14/h6-9H,3-5,10-12H2,1-2H3