[(2S)-1-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(2-amino-2-oxo-ethyl)piperazin-4-ium-1-yl]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(2-amino-2-oxoethyl)-1-piperazin-4-iumyl]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2-amino-2-oxoethyl)piperazin-4-ium-1-yl]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[4-(2-amino-2-keto-ethyl)piperazin-4-ium-1-yl]-2-keto-1-methyl-ethyl]ammonium Formula: C9H20N4O2+2 MolecularWeight: 216.2807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)CC(=O)N)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)N1CC[NH+](CC1)CC(=O)N)[NH3+]

InChI

InChI=1S/C9H18N4O2/c1-7(10)9(15)13-4-2-12(3-5-13)6-8(11)14/h7H,2-6,10H2,1H3,(H2,11,14)/p+2/t7-/m0/s1