1-[2-(2-bromanylphenoxy)propan-2-yl]-5-phenyl-pyrimidin-1-ium-2-amine chloride

Systemtic Name: 1-[2-(2-bromanylphenoxy)propan-2-yl]-5-phenyl-pyrimidin-1-ium-2-amine chloride Openeye Name: 1-[1-(2-bromophenoxy)-1-methyl-ethyl]-5-phenyl-pyrimidin-1-ium-2-amine chloride CAS Name: 1-[2-(2-bromophenoxy)propan-2-yl]-5-phenyl-2-pyrimidin-1-iumamine chloride IUPAC Name: 1-[2-(2-bromophenoxy)propan-2-yl]-5-phenylpyrimidin-1-ium-2-amine chloride Traditional Name: [1-[1-(2-bromophenoxy)-1-methyl-ethyl]-5-phenyl-pyrimidin-1-ium-2-yl]amine chloride Formula: C19H19BrClN3O MolecularWeight: 420.73066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)([N+]1=CC(=CN=C1N)C2=CC=CC=C2)OC3=CC=CC=C3Br.[Cl-]

Isomeric SMILES

CC(C)([N+]1=CC(=CN=C1N)C2=CC=CC=C2)OC3=CC=CC=C3Br.[Cl-]

InChI

InChI=1S/C19H18BrN3O.ClH/c1-19(2,24-17-11-7-6-10-16(17)20)23-13-15(12-22-18(23)21)14-8-4-3-5-9-14;/h3-13,21H,1-2H3;1H