2,4,8-tris(azanyl)-2-(4-azanylbutyl)-3-oxidanylidene-octanoic acid dihydrochloride

Systemtic Name: 2,4,8-tris(azanyl)-2-(4-azanylbutyl)-3-oxidanylidene-octanoic acid dihydrochloride Openeye Name: 2,4,8-triamino-2-(4-aminobutyl)-3-oxo-octanoic acid dihydrochloride CAS Name: 2,4,8-triamino-2-(4-aminobutyl)-3-oxooctanoic acid dihydrochloride IUPAC Name: 2,4,8-triamino-2-(4-aminobutyl)-3-oxooctanoic acid dihydrochloride Traditional Name: 2,4,8-triamino-2-(4-aminobutyl)-3-keto-caprylic acid dihydrochloride Formula: C12H28Cl2N4O3 MolecularWeight: 347.28172

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)C(CCCCN)(C(=O)O)N)N.Cl.Cl

Isomeric SMILES

C(CCN)CC(C(=O)C(CCCCN)(C(=O)O)N)N.Cl.Cl

InChI

InChI=1S/C12H26N4O3.2ClH/c13-7-3-1-5-9(15)10(17)12(16,11(18)19)6-2-4-8-14;;/h9H,1-8,13-16H2,(H,18,19);2*1H