phosphonomethylphosphonic acid; (E)-prop-1-ene-1,3-diamine

Systemtic Name: phosphonomethylphosphonic acid; (E)-prop-1-ene-1,3-diamine Openeye Name: phosphonomethylphosphonic acid; (E)-prop-1-ene-1,3-diamine CAS Name: phosphonomethylphosphonic acid; (E)-1-propene-1,3-diamine IUPAC Name: phosphonomethylphosphonic acid; (E)-prop-1-ene-1,3-diamine Traditional Name: [(E)-3-aminoallyl]amine; phosphonomethylphosphonic acid Formula: C7H32N2O24P8 MolecularWeight: 776.118068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C=CN)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

C(/C=C/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/C3H8N2.4CH6O6P2/c4-2-1-3-5;4*2-8(3,4)1-9(5,6)7/h1-2H,3-5H2;4*1H2,(H2,2,3,4)(H2,5,6,7)/b2-1+;;;;