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

Systemtic Name: (3-ethoxycarbonyl-5-oxidanyl-2-phenyl-1-benzofuran-4-yl)-dimethyl-azanium chloride Openeye Name: (3-ethoxycarbonyl-5-hydroxy-2-phenyl-benzofuran-4-yl)-dimethyl-ammonium chloride CAS Name: (3-ethoxycarbonyl-5-hydroxy-2-phenyl-4-benzofuranyl)-dimethylammonium chloride IUPAC Name: (3-ethoxycarbonyl-5-hydroxy-2-phenyl-1-benzofuran-4-yl)-dimethylazanium chloride Traditional Name: (3-carbethoxy-5-hydroxy-2-phenyl-benzofuran-4-yl)-dimethyl-ammonium chloride Formula: C19H20ClNO4 MolecularWeight: 361.8194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)[NH+](C)C)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)[NH+](C)C)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C19H19NO4.ClH/c1-4-23-19(22)16-15-14(11-10-13(21)17(15)20(2)3)24-18(16)12-8-6-5-7-9-12;/h5-11,21H,4H2,1-3H3;1H