2-(4,4-diphosphonobutylsulfanyl)ethanoic acid

Systemtic Name: 2-(4,4-diphosphonobutylsulfanyl)ethanoic acid Openeye Name: 2-(4,4-diphosphonobutylsulfanyl)acetic acid CAS Name: 2-(4,4-diphosphonobutylthio)acetic acid IUPAC Name: 2-(4,4-diphosphonobutylsulfanyl)acetic acid Traditional Name: 2-(4,4-diphosphonobutylthio)acetic acid Formula: C6H14O8P2S MolecularWeight: 308.183082

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(P(=O)(O)O)P(=O)(O)O)CSCC(=O)O

Isomeric SMILES

C(CC(P(=O)(O)O)P(=O)(O)O)CSCC(=O)O

InChI

InChI=1S/C6H14O8P2S/c7-5(8)4-17-3-1-2-6(15(9,10)11)16(12,13)14/h6H,1-4H2,(H,7,8)(H2,9,10,11)(H2,12,13,14)