phosphonomethylphosphonic acid; propane-1,1-diamine

Systemtic Name: phosphonomethylphosphonic acid; propane-1,1-diamine Openeye Name: phosphonomethylphosphonic acid; propane-1,1-diamine CAS Name: phosphonomethylphosphonic acid; propane-1,1-diamine IUPAC Name: phosphonomethylphosphonic acid; propane-1,1-diamine Traditional Name: 1-aminopropylamine; phosphonomethylphosphonic acid Formula: C7H34N2O24P8 MolecularWeight: 778.133948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H10N2.4CH6O6P2/c1-2-3(4)5;4*2-8(3,4)1-9(5,6)7/h3H,2,4-5H2,1H3;4*1H2,(H2,2,3,4)(H2,5,6,7)