[azanyl(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)ethanoic acid

Systemtic Name: [azanyl(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)ethanoic acid Openeye Name: [amino(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)acetic acid CAS Name: [amino(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)acetic acid IUPAC Name: [amino(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)acetic acid Traditional Name: [amino(diphosphono)methyl]phosphonic acid; 2-(phosphonomethylamino)acetic acid Formula: C4H16N2O14P4 MolecularWeight: 440.069884

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)NCP(=O)(O)O.C(N)(P(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(C(=O)O)NCP(=O)(O)O.C(N)(P(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C3H8NO5P.CH8NO9P3/c5-3(6)1-4-2-10(7,8)9;2-1(12(3,4)5,13(6,7)8)14(9,10)11/h4H,1-2H2,(H,5,6)(H2,7,8,9);2H2,(H2,3,4,5)(H2,6,7,8)(H2,9,10,11)