dimethyl-[(5-oxidanyl-3-thiophen-2-ylcarbonyl-1-benzofuran-4-yl)methyl]azanium chloride

Systemtic Name: dimethyl-[(5-oxidanyl-3-thiophen-2-ylcarbonyl-1-benzofuran-4-yl)methyl]azanium chloride Openeye Name: [5-hydroxy-3-(thiophene-2-carbonyl)benzofuran-4-yl]methyl-dimethyl-ammonium chloride CAS Name: [5-hydroxy-3-[oxo(thiophen-2-yl)methyl]-4-benzofuranyl]methyl-dimethylammonium chloride IUPAC Name: [5-hydroxy-3-(thiophene-2-carbonyl)-1-benzofuran-4-yl]methyl-dimethylazanium chloride Traditional Name: [5-hydroxy-3-(2-thenoyl)benzofuran-4-yl]methyl-dimethyl-ammonium chloride Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(=O)C3=CC=CS3)O.[Cl-]

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1C(=CO2)C(=O)C3=CC=CS3)O.[Cl-]

InChI

InChI=1S/C16H15NO3S.ClH/c1-17(2)8-10-12(18)5-6-13-15(10)11(9-20-13)16(19)14-4-3-7-21-14;/h3-7,9,18H,8H2,1-2H3;1H