N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; 2-phosphonoethylphosphonic acid

Systemtic Name: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; 2-phosphonoethylphosphonic acid Openeye Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 2-phosphonoethylphosphonic acid CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 2-phosphonoethylphosphonic acid IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 2-phosphonoethylphosphonic acid Traditional Name: 2-aminoethyl-[2-(2-aminoethylamino)ethyl]amine; 2-phosphonoethylphosphonic acid Formula: C18H66N4O36P12 MolecularWeight: 1286.406972

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Descriptors Computed from Structure

Canonical SMILES:

C(CNCCNCCN)N.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(CNCCNCCN)N.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O.C(CP(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H18N4.6C2H8O6P2/c7-1-3-9-5-6-10-4-2-8;6*3-9(4,5)1-2-10(6,7)8/h9-10H,1-8H2;6*1-2H2,(H2,3,4,5)(H2,6,7,8)