[4,7-dimethoxy-6-(2-piperidin-1-ium-2-ylethoxy)-1-benzofuran-5-yl]azanium dichloride

Systemtic Name: [4,7-dimethoxy-6-(2-piperidin-1-ium-2-ylethoxy)-1-benzofuran-5-yl]azanium dichloride Openeye Name: [4,7-dimethoxy-6-(2-piperidin-1-ium-2-ylethoxy)benzofuran-5-yl]ammonium dichloride CAS Name: [4,7-dimethoxy-6-[2-(2-piperidin-1-iumyl)ethoxy]-5-benzofuranyl]ammonium dichloride IUPAC Name: [4,7-dimethoxy-6-(2-piperidin-1-ium-2-ylethoxy)-1-benzofuran-5-yl]azanium dichloride Traditional Name: [4,7-dimethoxy-6-(2-piperidin-1-ium-2-ylethoxy)benzofuran-5-yl]ammonium dichloride Formula: C17H26Cl2N2O4 MolecularWeight: 393.30534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C=CO2)OC)OCCC3CCCC[NH2+]3)[NH3+].[Cl-].[Cl-]

Isomeric SMILES

COC1=C(C(=C(C2=C1C=CO2)OC)OCCC3CCCC[NH2+]3)[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C17H24N2O4.2ClH/c1-20-14-12-7-10-22-15(12)17(21-2)16(13(14)18)23-9-6-11-5-3-4-8-19-11;;/h7,10-11,19H,3-6,8-9,18H2,1-2H3;2*1H