1,2,3-triphosphonopropan-2-ylphosphonic acid

Systemtic Name: 1,2,3-triphosphonopropan-2-ylphosphonic acid Openeye Name: [1,2-diphosphono-1-(phosphonomethyl)ethyl]phosphonic acid CAS Name: 1,2,3-triphosphonopropan-2-ylphosphonic acid IUPAC Name: 1,2,3-triphosphonopropan-2-ylphosphonic acid Traditional Name: [1,2-diphosphono-1-(phosphonomethyl)ethyl]phosphonic acid Formula: C3H12O12P4 MolecularWeight: 364.015224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H12O12P4/c4-16(5,6)1-3(18(10,11)12,19(13,14)15)2-17(7,8)9/h1-2H2,(H2,4,5,6)(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)