2-octylbenzenesulfonate; 10-oxidanyldecylazanium

Systemtic Name: 2-octylbenzenesulfonate; 10-oxidanyldecylazanium Openeye Name: 10-hydroxydecylammonium; 2-octylbenzenesulfonate CAS Name: 10-hydroxydecylammonium; 2-octylbenzenesulfonate IUPAC Name: 10-hydroxydecylazanium; 2-octylbenzenesulfonate Traditional Name: 10-hydroxydecylammonium; 2-octylbesylate Formula: C24H45NO4S MolecularWeight: 443.6834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C(CCCCCO)CCCC[NH3+]

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C(CCCCCO)CCCC[NH3+]

InChI

InChI=1S/C14H22O3S.C10H23NO/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)18(15,16)17;11-9-7-5-3-1-2-4-6-8-10-12/h8-9,11-12H,2-7,10H2,1H3,(H,15,16,17);12H,1-11H2