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4,4-bis(dodecylsulfanyl)pentanoic acid; 2-(2-hydroxyethylamino)ethanol

4,4-bis(dodecylsulfanyl)pentanoic acid; 2-(2-hydroxyethylamino)ethanol

Systemtic Name:4,4-bis(dodecylsulfanyl)pentanoic acid; 2-(2-hydroxyethylamino)ethanol
Openeye Name:4,4-bis(dodecylsulfanyl)pentanoic acid; 2-(2-hydroxyethylamino)ethanol
CAS Name:4,4-bis(dodecylthio)pentanoic acid; 2-(2-hydroxyethylamino)ethanol
IUPAC Name:4,4-bis(dodecylsulfanyl)pentanoic acid; 2-(2-hydroxyethylamino)ethanol
Traditional Name:4,4-bis(laurylthio)valeric acid; 2-(2-hydroxyethylamino)ethanol
Formula: C33H69NO4S2
MolecularWeight: 608.03526
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C)(CCC(=O)O)SCCCCCCCCCCCC.C(CO)NCCO


Isomeric SMILES

CCCCCCCCCCCCSC(C)(CCC(=O)O)SCCCCCCCCCCCC.C(CO)NCCO


InChI

InChI=1S/C29H58O2S2.C4H11NO2/c1-4-6-8-10-12-14-16-18-20-22-26-32-29(3,25-24-28(30)31)33-27-23-21-19-17-15-13-11-9-7-5-2;6-3-1-5-2-4-7/h4-27H2,1-3H3,(H,30,31);5-7H,1-4H2


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