N',N'-bis(2-azanylethyl)ethane-1,2-diamine; 6-phosphonohexylphosphonic acid

Systemtic Name: N',N'-bis(2-azanylethyl)ethane-1,2-diamine; 6-phosphonohexylphosphonic acid Openeye Name: N',N'-bis(2-aminoethyl)ethane-1,2-diamine; 6-phosphonohexylphosphonic acid CAS Name: N',N'-bis(2-aminoethyl)ethane-1,2-diamine; 6-phosphonohexylphosphonic acid IUPAC Name: N',N'-bis(2-aminoethyl)ethane-1,2-diamine; 6-phosphonohexylphosphonic acid Traditional Name: 6-phosphonohexylphosphonic acid; tris(2-aminoethyl)amine Formula: C12H34N4O6P2 MolecularWeight: 392.369082

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCP(=O)(O)O)CCP(=O)(O)O.C(CN(CCN)CCN)N

Isomeric SMILES

C(CCCP(=O)(O)O)CCP(=O)(O)O.C(CN(CCN)CCN)N

InChI

InChI=1S/C6H18N4.C6H16O6P2/c7-1-4-10(5-2-8)6-3-9;7-13(8,9)5-3-1-2-4-6-14(10,11)12/h1-9H2;1-6H2,(H2,7,8,9)(H2,10,11,12)