[3-(2,5-dimethoxyphenyl)carbonyl-2-methyl-5-oxidanyl-1-benzofuran-4-yl]methyl-dimethyl-azanium chloride

Systemtic Name: [3-(2,5-dimethoxyphenyl)carbonyl-2-methyl-5-oxidanyl-1-benzofuran-4-yl]methyl-dimethyl-azanium chloride Openeye Name: [3-(2,5-dimethoxybenzoyl)-5-hydroxy-2-methyl-benzofuran-4-yl]methyl-dimethyl-ammonium chloride CAS Name: [3-[(2,5-dimethoxyphenyl)-oxomethyl]-5-hydroxy-2-methyl-4-benzofuranyl]methyl-dimethylammonium chloride IUPAC Name: [3-(2,5-dimethoxybenzoyl)-5-hydroxy-2-methyl-1-benzofuran-4-yl]methyl-dimethylazanium chloride Traditional Name: [3-(2,5-dimethoxybenzoyl)-5-hydroxy-2-methyl-benzofuran-4-yl]methyl-dimethyl-ammonium chloride Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)C(=O)C3=C(C=CC(=C3)OC)OC.[Cl-]

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)C(=O)C3=C(C=CC(=C3)OC)OC.[Cl-]

InChI

InChI=1S/C21H23NO5.ClH/c1-12-19(21(24)14-10-13(25-4)6-8-17(14)26-5)20-15(11-22(2)3)16(23)7-9-18(20)27-12;/h6-10,23H,11H2,1-5H3;1H