6-oxidanyl-6,6-diphosphono-hexane-1-sulfonic acid

Systemtic Name: 6-oxidanyl-6,6-diphosphono-hexane-1-sulfonic acid Openeye Name: 6-hydroxy-6,6-diphosphono-hexane-1-sulfonic acid CAS Name: 6-hydroxy-6,6-diphosphono-1-hexanesulfonic acid IUPAC Name: 6-hydroxy-6,6-diphosphonohexane-1-sulfonic acid Traditional Name: 6-hydroxy-6,6-diphosphono-hexane-1-sulfonic acid Formula: C6H16O10P2S MolecularWeight: 342.197762

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(O)(P(=O)(O)O)P(=O)(O)O)CCS(=O)(=O)O

Isomeric SMILES

C(CCC(O)(P(=O)(O)O)P(=O)(O)O)CCS(=O)(=O)O

InChI

InChI=1S/C6H16O10P2S/c7-6(17(8,9)10,18(11,12)13)4-2-1-3-5-19(14,15)16/h7H,1-5H2,(H2,8,9,10)(H2,11,12,13)(H,14,15,16)