hexane-1,1,6-triamine; 5-phosphonopentylphosphonic acid

Systemtic Name: hexane-1,1,6-triamine; 5-phosphonopentylphosphonic acid Openeye Name: hexane-1,1,6-triamine; 5-phosphonopentylphosphonic acid CAS Name: hexane-1,1,6-triamine; 5-phosphonopentylphosphonic acid IUPAC Name: hexane-1,1,6-triamine; 5-phosphonopentylphosphonic acid Traditional Name: 1,6-diaminohexylamine; 5-phosphonopentylphosphonic acid Formula: C11H31N3O6P2 MolecularWeight: 363.327862

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(N)N)CCN.C(CCP(=O)(O)O)CCP(=O)(O)O

Isomeric SMILES

C(CCC(N)N)CCN.C(CCP(=O)(O)O)CCP(=O)(O)O

InChI

InChI=1S/C6H17N3.C5H14O6P2/c7-5-3-1-2-4-6(8)9;6-12(7,8)4-2-1-3-5-13(9,10)11/h6H,1-5,7-9H2;1-5H2,(H2,6,7,8)(H2,9,10,11)