2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]ethanoate

Systemtic Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]ethanoate Openeye Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]acetate CAS Name: 2-[[3-(4-methyl-1-piperazin-4-iumyl)-1-oxopropyl]amino]acetate IUPAC Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]acetate Traditional Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]acetate Formula: C10H19N3O3 MolecularWeight: 229.27616

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC(=O)NCC(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)CCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C10H19N3O3/c1-12-4-6-13(7-5-12)3-2-9(14)11-8-10(15)16/h2-8H2,1H3,(H,11,14)(H,15,16)