[2,2-bis(diphosphonomethyl)-1,4,4-triphosphono-butyl]phosphonic acid

Systemtic Name: [2,2-bis(diphosphonomethyl)-1,4,4-triphosphono-butyl]phosphonic acid Openeye Name: [2,2-bis(diphosphonomethyl)-1,4,4-triphosphono-butyl]phosphonic acid CAS Name: [2,2-bis(diphosphonomethyl)-1,4,4-triphosphonobutyl]phosphonic acid IUPAC Name: [2,2-bis(diphosphonomethyl)-1,4,4-triphosphonobutyl]phosphonic acid Traditional Name: [2,2-bis(diphosphonomethyl)-1,4,4-triphosphono-butyl]phosphonic acid Formula: C6H22O24P8 MolecularWeight: 726.014568

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Descriptors Computed from Structure

Canonical SMILES:

C(C(P(=O)(O)O)P(=O)(O)O)C(C(P(=O)(O)O)P(=O)(O)O)(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(C(P(=O)(O)O)P(=O)(O)O)C(C(P(=O)(O)O)P(=O)(O)O)(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H22O24P8/c7-31(8,9)2(32(10,11)12)1-6(3(33(13,14)15)34(16,17)18,4(35(19,20)21)36(22,23)24)5(37(25,26)27)38(28,29)30/h2-5H,1H2,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)(H2,25,26,27)(H2,28,29,30)