bis(2-methyl-3-oxidanyl-propyl)azanium; 2-dodecylbenzenesulfonate

Systemtic Name: bis(2-methyl-3-oxidanyl-propyl)azanium; 2-dodecylbenzenesulfonate Openeye Name: bis(3-hydroxy-2-methyl-propyl)ammonium; 2-dodecylbenzenesulfonate CAS Name: bis(3-hydroxy-2-methylpropyl)ammonium; 2-dodecylbenzenesulfonate IUPAC Name: bis(3-hydroxy-2-methylpropyl)azanium; 2-dodecylbenzenesulfonate Traditional Name: bis(3-hydroxy-2-methyl-propyl)ammonium; 2-laurylbesylate Formula: C26H49NO5S MolecularWeight: 487.73596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C[NH2+]CC(C)CO)CO

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C[NH2+]CC(C)CO)CO

InChI

InChI=1S/C18H30O3S.C8H19NO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-7(5-10)3-9-4-8(2)6-11/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);7-11H,3-6H2,1-2H3