2-dodecylbenzenesulfonate; morpholin-4-ium

Systemtic Name: 2-dodecylbenzenesulfonate; morpholin-4-ium Openeye Name: 2-dodecylbenzenesulfonate; morpholin-4-ium CAS Name: 2-dodecylbenzenesulfonate; morpholin-4-ium IUPAC Name: 2-dodecylbenzenesulfonate; morpholin-4-ium Traditional Name: 2-laurylbesylate; morpholin-4-ium Formula: C22H39NO4S MolecularWeight: 413.61436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1COCC[NH2+]1

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1COCC[NH2+]1

InChI

InChI=1S/C18H30O3S.C4H9NO/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-3-6-4-2-5-1/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);5H,1-4H2