carbamimidoyl-[6-(carbamimidoylazaniumyl)hexyl]azanium diethanoate

Systemtic Name: carbamimidoyl-[6-(carbamimidoylazaniumyl)hexyl]azanium diethanoate Openeye Name: carbamimidoyl-[6-(carbamimidoylammonio)hexyl]ammonium diacetate CAS Name: carbamimidoyl-[6-(carbamimidoylammonio)hexyl]ammonium diacetate IUPAC Name: carbamimidoyl-[6-(carbamimidoylazaniumyl)hexyl]azanium diacetate Traditional Name: amidino-[6-(amidinoammonio)hexyl]ammonium diacetate Formula: C12H28N6O4 MolecularWeight: 320.38852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].C(CCC[NH2+]C(=N)N)CC[NH2+]C(=N)N

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].C(CCC[NH2+]C(=N)N)CC[NH2+]C(=N)N

InChI

InChI=1S/C8H20N6.2C2H4O2/c9-7(10)13-5-3-1-2-4-6-14-8(11)12;2*1-2(3)4/h1-6H2,(H4,9,10,13)(H4,11,12,14);2*1H3,(H,3,4)