3-(4-ethylpiperazine-1,4-diium-1-yl)propanoate

Systemtic Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)propanoate Openeye Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)propanoate CAS Name: 3-(4-ethyl-1-piperazine-1,4-diiumyl)propanoate IUPAC Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)propanoate Traditional Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)propionate Formula: C9H19N2O2+ MolecularWeight: 187.25936

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCC(=O)[O-]

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCC(=O)[O-]

InChI

InChI=1S/C9H18N2O2/c1-2-10-5-7-11(8-6-10)4-3-9(12)13/h2-8H2,1H3,(H,12,13)/p+1