ethyl 4-(2-methyl-3-propyl-imidazol-3-ium-1-yl)butanoate

Systemtic Name: ethyl 4-(2-methyl-3-propyl-imidazol-3-ium-1-yl)butanoate Openeye Name: ethyl 4-(2-methyl-3-propyl-imidazol-3-ium-1-yl)butanoate CAS Name: 4-(2-methyl-3-propyl-1-imidazol-3-iumyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-3-propylimidazol-3-ium-1-yl)butanoate Traditional Name: 4-(2-methyl-3-propyl-imidazol-3-ium-1-yl)butyric acid ethyl ester Formula: C13H23N2O2+ MolecularWeight: 239.33392

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(N(C=C1)CCCC(=O)OCC)C

Isomeric SMILES

CCC[N+]1=C(N(C=C1)CCCC(=O)OCC)C

InChI

InChI=1S/C13H23N2O2/c1-4-8-14-10-11-15(12(14)3)9-6-7-13(16)17-5-2/h10-11H,4-9H2,1-3H3/q+1