2-[[3-(4-ethylpiperazin-4-ium-1-yl)-2,2-dimethyl-propanoyl]amino]ethanoate

Systemtic Name: 2-[[3-(4-ethylpiperazin-4-ium-1-yl)-2,2-dimethyl-propanoyl]amino]ethanoate Openeye Name: 2-[[3-(4-ethylpiperazin-4-ium-1-yl)-2,2-dimethyl-propanoyl]amino]acetate CAS Name: 2-[[3-(4-ethyl-1-piperazin-4-iumyl)-2,2-dimethyl-1-oxopropyl]amino]acetate IUPAC Name: 2-[[3-(4-ethylpiperazin-4-ium-1-yl)-2,2-dimethylpropanoyl]amino]acetate Traditional Name: 2-[[3-(4-ethylpiperazin-4-ium-1-yl)-2,2-dimethyl-propanoyl]amino]acetate Formula: C13H25N3O3 MolecularWeight: 271.3559

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H25N3O3/c1-4-15-5-7-16(8-6-15)10-13(2,3)12(19)14-9-11(17)18/h4-10H2,1-3H3,(H,14,19)(H,17,18)