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

Systemtic Name: 3-oxidanylidene-3-[3-oxidanyl-2-propanoyloxy-1,1-bis(tridecylsulfanyl)propoxy]propanoic acid Openeye Name: 3-[3-hydroxy-2-propanoyloxy-1,1-bis(tridecylsulfanyl)propoxy]-3-oxo-propanoic acid CAS Name: 3-[3-hydroxy-2-(1-oxopropoxy)-1,1-bis(tridecylthio)propoxy]-3-oxopropanoic acid IUPAC Name: 3-[3-hydroxy-2-propanoyloxy-1,1-bis(tridecylsulfanyl)propoxy]-3-oxopropanoic acid Traditional Name: 3-[3-hydroxy-2-propionyloxy-1,1-bis(tridecylthio)propoxy]-3-keto-propionic acid Formula: C35H66O7S2 MolecularWeight: 663.02434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCSC(C(CO)OC(=O)CC)(OC(=O)CC(=O)O)SCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCSC(C(CO)OC(=O)CC)(OC(=O)CC(=O)O)SCCCCCCCCCCCCC

InChI

InChI=1S/C35H66O7S2/c1-4-7-9-11-13-15-17-19-21-23-25-27-43-35(42-34(40)29-32(37)38,31(30-36)41-33(39)6-3)44-28-26-24-22-20-18-16-14-12-10-8-5-2/h31,36H,4-30H2,1-3H3,(H,37,38)