1-[2-[2-[bis(2-oxidanylpropyl)amino]ethylamino]ethylamino]propan-2-ol; 3-dodecylbenzenesulfonate

Systemtic Name: 1-[2-[2-[bis(2-oxidanylpropyl)amino]ethylamino]ethylamino]propan-2-ol; 3-dodecylbenzenesulfonate Openeye Name: 1-[2-[2-[bis(2-hydroxypropyl)amino]ethylamino]ethylamino]propan-2-ol; 3-dodecylbenzenesulfonate CAS Name: 1-[2-[2-[bis(2-hydroxypropyl)amino]ethylamino]ethylamino]-2-propanol; 3-dodecylbenzenesulfonate IUPAC Name: 1-[2-[2-[bis(2-hydroxypropyl)amino]ethylamino]ethylamino]propan-2-ol; 3-dodecylbenzenesulfonate Traditional Name: 1-[2-[2-[bis(2-hydroxypropyl)amino]ethylamino]ethylamino]propan-2-ol; 3-laurylbesylate Formula: C31H60N3O6S- MolecularWeight: 602.8896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)[O-].CC(CNCCNCCN(CC(C)O)CC(C)O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)[O-].CC(CNCCNCCN(CC(C)O)CC(C)O)O

InChI

InChI=1S/C18H30O3S.C13H31N3O3/c1-2-3-4-5-6-7-8-9-10-11-13-17-14-12-15-18(16-17)22(19,20)21;1-11(17)8-15-5-4-14-6-7-16(9-12(2)18)10-13(3)19/h12,14-16H,2-11,13H2,1H3,(H,19,20,21);11-15,17-19H,4-10H2,1-3H3/p-1