[3-(4-chlorophenyl)carbonyl-5-oxidanyl-1-benzofuran-4-yl]methyl-dimethyl-azanium chloride

Systemtic Name: [3-(4-chlorophenyl)carbonyl-5-oxidanyl-1-benzofuran-4-yl]methyl-dimethyl-azanium chloride Openeye Name: [3-(4-chlorobenzoyl)-5-hydroxy-benzofuran-4-yl]methyl-dimethyl-ammonium chloride CAS Name: [3-[(4-chlorophenyl)-oxomethyl]-5-hydroxy-4-benzofuranyl]methyl-dimethylammonium chloride IUPAC Name: [3-(4-chlorobenzoyl)-5-hydroxy-1-benzofuran-4-yl]methyl-dimethylazanium chloride Traditional Name: [3-(4-chlorobenzoyl)-5-hydroxy-benzofuran-4-yl]methyl-dimethyl-ammonium chloride Formula: C18H17Cl2NO3 MolecularWeight: 366.23848

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(=O)C3=CC=C(C=C3)Cl)O.[Cl-]

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(=O)C3=CC=C(C=C3)Cl)O.[Cl-]

InChI

InChI=1S/C18H16ClNO3.ClH/c1-20(2)9-13-15(21)7-8-16-17(13)14(10-23-16)18(22)11-3-5-12(19)6-4-11;/h3-8,10,21H,9H2,1-2H3;1H