hexane-1,6-diamine; (phosphonocarbamoylamino)phosphonic acid

Systemtic Name: hexane-1,6-diamine; (phosphonocarbamoylamino)phosphonic acid Openeye Name: hexane-1,6-diamine; (phosphonocarbamoylamino)phosphonic acid CAS Name: hexane-1,6-diamine; [[oxo-(phosphonoamino)methyl]amino]phosphonic acid IUPAC Name: hexane-1,6-diamine; (phosphonocarbamoylamino)phosphonic acid Traditional Name: 6-aminohexylamine; (phosphonocarbamoylamino)phosphonic acid Formula: C13H38N6O7P2 MolecularWeight: 452.424342

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN)CCN.C(CCCN)CCN.C(=O)(NP(=O)(O)O)NP(=O)(O)O

Isomeric SMILES

C(CCCN)CCN.C(CCCN)CCN.C(=O)(NP(=O)(O)O)NP(=O)(O)O

InChI

InChI=1S/2C6H16N2.CH6N2O7P2/c2*7-5-3-1-2-4-6-8;4-1(2-11(5,6)7)3-12(8,9)10/h2*1-8H2;(H6,2,3,4,5,6,7,8,9,10)