2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride

Systemtic Name: 2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride Openeye Name: 2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride CAS Name: 2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride IUPAC Name: 2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride Traditional Name: 2-(3-tert-butyl-1H-pyrazol-2-ium-5-yl)ethanol chloride Formula: C9H17ClN2O MolecularWeight: 204.69708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=[NH+]NC(=C1)CCO.[Cl-]

Isomeric SMILES

CC(C)(C)C1=[NH+]NC(=C1)CCO.[Cl-]

InChI

InChI=1S/C9H16N2O.ClH/c1-9(2,3)8-6-7(4-5-12)10-11-8;/h6,12H,4-5H2,1-3H3,(H,10,11);1H