3-dodecoxypropyl 4-methylbenzenesulfonate

Systemtic Name: 3-dodecoxypropyl 4-methylbenzenesulfonate Openeye Name: 3-dodecoxypropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-dodecoxypropyl ester IUPAC Name: 3-dodecoxypropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-lauryloxypropyl ester Formula: C22H38O4S MolecularWeight: 398.59972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCCCOCCCOS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C22H38O4S/c1-3-4-5-6-7-8-9-10-11-12-18-25-19-13-20-26-27(23,24)22-16-14-21(2)15-17-22/h14-17H,3-13,18-20H2,1-2H3