[[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphono-methyl]phosphonic acid Openeye Name: [[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphono-methyl]phosphonic acid CAS Name: [[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphonomethyl]phosphonic acid IUPAC Name: [[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphonomethyl]phosphonic acid Traditional Name: [[2-[bis(diphosphonomethyl)amino]ethylamino]-phosphono-methyl]phosphonic acid Formula: C5H20N2O18P6 MolecularWeight: 582.057466

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Descriptors Computed from Structure

Canonical SMILES:

C(CN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(CN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O)NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H20N2O18P6/c8-26(9,10)3(27(11,12)13)6-1-2-7(4(28(14,15)16)29(17,18)19)5(30(20,21)22)31(23,24)25/h3-6H,1-2H2,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)(H2,23,24,25)