propan-2-yl 2-dodecylbenzenesulfonate

Systemtic Name: propan-2-yl 2-dodecylbenzenesulfonate Openeye Name: isopropyl 2-dodecylbenzenesulfonate CAS Name: 2-dodecylbenzenesulfonic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-dodecylbenzenesulfonate Traditional Name: 2-laurylbenzenesulfonic acid isopropyl ester Formula: C21H36O3S MolecularWeight: 368.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)OC(C)C

InChI

InChI=1S/C21H36O3S/c1-4-5-6-7-8-9-10-11-12-13-16-20-17-14-15-18-21(20)25(22,23)24-19(2)3/h14-15,17-19H,4-13,16H2,1-3H3