3-[1,1-bis(dodecylsulfanyl)-3-oxidanyl-2-propanoyloxy-propoxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[1,1-bis(dodecylsulfanyl)-3-oxidanyl-2-propanoyloxy-propoxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-[1,1-bis(dodecylsulfanyl)-3-hydroxy-2-propanoyloxy-propoxy]-3-oxo-propanoic acid CAS Name: 3-[1,1-bis(dodecylthio)-3-hydroxy-2-(1-oxopropoxy)propoxy]-3-oxopropanoic acid IUPAC Name: 3-[1,1-bis(dodecylsulfanyl)-3-hydroxy-2-propanoyloxypropoxy]-3-oxopropanoic acid Traditional Name: 3-[3-hydroxy-1,1-bis(laurylthio)-2-propionyloxy-propoxy]-3-keto-propionic acid Formula: C33H62O7S2 MolecularWeight: 634.97118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C(CO)OC(=O)CC)(OC(=O)CC(=O)O)SCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSC(C(CO)OC(=O)CC)(OC(=O)CC(=O)O)SCCCCCCCCCCCC

InChI

InChI=1S/C33H62O7S2/c1-4-7-9-11-13-15-17-19-21-23-25-41-33(40-32(38)27-30(35)36,29(28-34)39-31(37)6-3)42-26-24-22-20-18-16-14-12-10-8-5-2/h29,34H,4-28H2,1-3H3,(H,35,36)