(2S)-2-(3-ethylimidazol-3-ium-1-yl)-4-methyl-pentan-1-ol

Systemtic Name: (2S)-2-(3-ethylimidazol-3-ium-1-yl)-4-methyl-pentan-1-ol Openeye Name: (2S)-2-(3-ethylimidazol-3-ium-1-yl)-4-methyl-pentan-1-ol CAS Name: (2S)-2-(3-ethyl-1-imidazol-3-iumyl)-4-methyl-1-pentanol IUPAC Name: (2S)-2-(3-ethylimidazol-3-ium-1-yl)-4-methylpentan-1-ol Traditional Name: (2S)-2-(3-ethylimidazol-3-ium-1-yl)-4-methyl-pentan-1-ol Formula: C11H21N2O+ MolecularWeight: 197.29724

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(C=C1)C(CC(C)C)CO

Isomeric SMILES

CC[N+]1=CN(C=C1)[C@@H](CC(C)C)CO

InChI

InChI=1S/C11H21N2O/c1-4-12-5-6-13(9-12)11(8-14)7-10(2)3/h5-6,9-11,14H,4,7-8H2,1-3H3/q+1/t11-/m0/s1