3-[1-(2-carboxyethylsulfanyl)-8-methyl-nonyl]sulfanylpropanoic acid

Systemtic Name: 3-[1-(2-carboxyethylsulfanyl)-8-methyl-nonyl]sulfanylpropanoic acid Openeye Name: 3-[1-(2-carboxyethylsulfanyl)-8-methyl-nonyl]sulfanylpropanoic acid CAS Name: 3-[[1-(2-carboxyethylthio)-8-methylnonyl]thio]propanoic acid IUPAC Name: 3-[1-(2-carboxyethylsulfanyl)-8-methylnonyl]sulfanylpropanoic acid Traditional Name: 3-[[1-(2-carboxyethylthio)-8-methyl-nonyl]thio]propionic acid Formula: C16H30O4S2 MolecularWeight: 350.537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCC(SCCC(=O)O)SCCC(=O)O

Isomeric SMILES

CC(C)CCCCCCC(SCCC(=O)O)SCCC(=O)O

InChI

InChI=1S/C16H30O4S2/c1-13(2)7-5-3-4-6-8-16(21-11-9-14(17)18)22-12-10-15(19)20/h13,16H,3-12H2,1-2H3,(H,17,18)(H,19,20)