(3-bromanyl-5-oxidanyl-2-phenyl-1-benzofuran-4-yl)methyl-dimethyl-azanium chloride

Systemtic Name: (3-bromanyl-5-oxidanyl-2-phenyl-1-benzofuran-4-yl)methyl-dimethyl-azanium chloride Openeye Name: (3-bromo-5-hydroxy-2-phenyl-benzofuran-4-yl)methyl-dimethyl-ammonium chloride CAS Name: (3-bromo-5-hydroxy-2-phenyl-4-benzofuranyl)methyl-dimethylammonium chloride IUPAC Name: (3-bromo-5-hydroxy-2-phenyl-1-benzofuran-4-yl)methyl-dimethylazanium chloride Traditional Name: (3-bromo-5-hydroxy-2-phenyl-benzofuran-4-yl)methyl-dimethyl-ammonium chloride Formula: C17H17BrClNO2 MolecularWeight: 382.67938

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1C(=C(O2)C3=CC=CC=C3)Br)O.[Cl-]

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1C(=C(O2)C3=CC=CC=C3)Br)O.[Cl-]

InChI

InChI=1S/C17H16BrNO2.ClH/c1-19(2)10-12-13(20)8-9-14-15(12)16(18)17(21-14)11-6-4-3-5-7-11;/h3-9,20H,10H2,1-2H3;1H