4-tert-butyl-2-chloranyl-6-(pyridin-1-ium-1-ylmethyl)phenol chloride

Systemtic Name: 4-tert-butyl-2-chloranyl-6-(pyridin-1-ium-1-ylmethyl)phenol chloride Openeye Name: 4-tert-butyl-2-chloro-6-(pyridin-1-ium-1-ylmethyl)phenol chloride CAS Name: 4-tert-butyl-2-chloro-6-(1-pyridin-1-iumylmethyl)phenol chloride IUPAC Name: 4-tert-butyl-2-chloro-6-(pyridin-1-ium-1-ylmethyl)phenol chloride Traditional Name: 4-tert-butyl-2-chloro-6-(pyridin-1-ium-1-ylmethyl)phenol chloride Formula: C16H19Cl2NO MolecularWeight: 312.23416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClNO.ClH/c1-16(2,3)13-9-12(15(19)14(17)10-13)11-18-7-5-4-6-8-18;/h4-10H,11H2,1-3H3;1H