2-[1,4,4-tris(carboxymethylsulfanyl)butylsulfanyl]ethanoic acid

Systemtic Name: 2-[1,4,4-tris(carboxymethylsulfanyl)butylsulfanyl]ethanoic acid Openeye Name: 2-[1,4,4-tris(carboxymethylsulfanyl)butylsulfanyl]acetic acid CAS Name: 2-[1,4,4-tris(carboxymethylthio)butylthio]acetic acid IUPAC Name: 2-[1,4,4-tris(carboxymethylsulfanyl)butylsulfanyl]acetic acid Traditional Name: 2-[1,4,4-tris(carboxymethylthio)butylthio]acetic acid Formula: C12H18O8S4 MolecularWeight: 418.52652

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(SCC(=O)O)SCC(=O)O)C(SCC(=O)O)SCC(=O)O

Isomeric SMILES

C(CC(SCC(=O)O)SCC(=O)O)C(SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C12H18O8S4/c13-7(14)3-21-11(22-4-8(15)16)1-2-12(23-5-9(17)18)24-6-10(19)20/h11-12H,1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)