hexaazanium N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine hexaethanoate

Systemtic Name: hexaazanium N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine hexaethanoate Openeye Name: hexaammonium N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine hexaacetate CAS Name: hexaammonium N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine hexaacetate IUPAC Name: hexaazanium N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine hexaacetate Traditional Name: hexaammonium 2-aminoethyl-[2-(2-aminoethylamino)ethyl]amine hexaacetate Formula: C18H60N10O12 MolecularWeight: 608.7288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C(CNCCNCCN)N.[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C(CNCCNCCN)N.[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]

InChI

InChI=1S/C6H18N4.6C2H4O2.6H3N/c7-1-3-9-5-6-10-4-2-8;6*1-2(3)4;;;;;;/h9-10H,1-8H2;6*1H3,(H,3,4);6*1H3