2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride

Systemtic Name: 2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride Openeye Name: 2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride CAS Name: 2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride IUPAC Name: 2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride Traditional Name: 2-tert-butyl-4-(1H-imidazol-3-ium-3-ylmethyl)phenol chloride Formula: C14H19ClN2O MolecularWeight: 266.76646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C[N+]2=CNC=C2)O.[Cl-]

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C[N+]2=CNC=C2)O.[Cl-]

InChI

InChI=1S/C14H18N2O.ClH/c1-14(2,3)12-8-11(4-5-13(12)17)9-16-7-6-15-10-16;/h4-8,10,17H,9H2,1-3H3;1H