2-[4-(4-ethylpiperazin-4-ium-1-yl)butanoylamino]ethanoate

Systemtic Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)butanoylamino]ethanoate Openeye Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)butanoylamino]acetate CAS Name: 2-[[4-(4-ethyl-1-piperazin-4-iumyl)-1-oxobutyl]amino]acetate IUPAC Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)butanoylamino]acetate Traditional Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)butanoylamino]acetate Formula: C12H23N3O3 MolecularWeight: 257.32932

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCCC(=O)NCC(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)CCCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C12H23N3O3/c1-2-14-6-8-15(9-7-14)5-3-4-11(16)13-10-12(17)18/h2-10H2,1H3,(H,13,16)(H,17,18)