2-octoxyethyl 4-methylbenzenesulfonate

Systemtic Name: 2-octoxyethyl 4-methylbenzenesulfonate Openeye Name: 2-octoxyethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-octoxyethyl ester IUPAC Name: 2-octoxyethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-octoxyethyl ester Formula: C17H28O4S MolecularWeight: 328.46682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCOCCOS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H28O4S/c1-3-4-5-6-7-8-13-20-14-15-21-22(18,19)17-11-9-16(2)10-12-17/h9-12H,3-8,13-15H2,1-2H3