1,1-diphosphonononan-2-ylphosphonic acid

Systemtic Name: 1,1-diphosphonononan-2-ylphosphonic acid Openeye Name: 1-(diphosphonomethyl)octylphosphonic acid CAS Name: 1,1-diphosphonononan-2-ylphosphonic acid IUPAC Name: 1,1-diphosphonononan-2-ylphosphonic acid Traditional Name: 1-(diphosphonomethyl)octylphosphonic acid Formula: C9H23O9P3 MolecularWeight: 368.194803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H23O9P3/c1-2-3-4-5-6-7-8(19(10,11)12)9(20(13,14)15)21(16,17)18/h8-9H,2-7H2,1H3,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)