N-(2-ethanoyl-1-benzofuran-3-yl)-2-piperidin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-(2-ethanoyl-1-benzofuran-3-yl)-2-piperidin-1-ium-1-yl-ethanamide chloride Openeye Name: N-(2-acetylbenzofuran-3-yl)-2-piperidin-1-ium-1-yl-acetamide chloride CAS Name: N-(2-acetyl-3-benzofuranyl)-2-(1-piperidin-1-iumyl)acetamide chloride IUPAC Name: N-(2-acetyl-1-benzofuran-3-yl)-2-piperidin-1-ium-1-ylacetamide chloride Traditional Name: N-(2-acetylbenzofuran-3-yl)-2-piperidin-1-ium-1-yl-acetamide chloride Formula: C17H21ClN2O3 MolecularWeight: 336.81324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C[NH+]3CCCCC3.[Cl-]

Isomeric SMILES

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C[NH+]3CCCCC3.[Cl-]

InChI

InChI=1S/C17H20N2O3.ClH/c1-12(20)17-16(13-7-3-4-8-14(13)22-17)18-15(21)11-19-9-5-2-6-10-19;/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,18,21);1H