[(3S,4S)-3-[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]heptan-4-yl]azanium

Systemtic Name: [(3S,4S)-3-[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-(4-ethyl-2,3-dioxo-piperazin-1-yl)-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-(4-ethyl-2,3-dioxo-1-piperazinyl)heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-(4-ethyl-2,3-dioxopiperazin-1-yl)heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-(4-ethyl-2,3-diketo-piperazino)-1-propyl-butyl]ammonium Formula: C13H26N3O2+ MolecularWeight: 256.36444

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)N1CCN(C(=O)C1=O)CC)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)N1CCN(C(=O)C1=O)CC)[NH3+]

InChI

InChI=1S/C13H25N3O2/c1-4-7-10(14)11(5-2)16-9-8-15(6-3)12(17)13(16)18/h10-11H,4-9,14H2,1-3H3/p+1/t10-,11-/m0/s1