[5-chloranyl-3-(4-methoxyphenyl)-1-benzofuran-2-yl]methyl-diethyl-azanium chloride

Systemtic Name: [5-chloranyl-3-(4-methoxyphenyl)-1-benzofuran-2-yl]methyl-diethyl-azanium chloride Openeye Name: [5-chloro-3-(4-methoxyphenyl)benzofuran-2-yl]methyl-diethyl-ammonium chloride CAS Name: [5-chloro-3-(4-methoxyphenyl)-2-benzofuranyl]methyl-diethylammonium chloride IUPAC Name: [5-chloro-3-(4-methoxyphenyl)-1-benzofuran-2-yl]methyl-diethylazanium chloride Traditional Name: [5-chloro-3-(4-methoxyphenyl)benzofuran-2-yl]methyl-diethyl-ammonium chloride Formula: C20H23Cl2NO2 MolecularWeight: 380.30812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO2.ClH/c1-4-22(5-2)13-19-20(14-6-9-16(23-3)10-7-14)17-12-15(21)8-11-18(17)24-19;/h6-12H,4-5,13H2,1-3H3;1H