2-(6-ethyl-1-benzofuran-3-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide

Systemtic Name: 2-(6-ethyl-1-benzofuran-3-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide Openeye Name: 2-(6-ethylbenzofuran-3-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide CAS Name: 2-(6-ethyl-3-benzofuranyl)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]acetamide IUPAC Name: 2-(6-ethyl-1-benzofuran-3-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Traditional Name: 2-(6-ethylbenzofuran-3-yl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Formula: C21H31N2O2+ MolecularWeight: 343.48304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)NCCC[NH+]3CCCCC3C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)NCCC[NH+]3CCCC[C@@H]3C

InChI

InChI=1S/C21H30N2O2/c1-3-17-8-9-19-18(15-25-20(19)13-17)14-21(24)22-10-6-12-23-11-5-4-7-16(23)2/h8-9,13,15-16H,3-7,10-12,14H2,1-2H3,(H,22,24)/p+1/t16-/m0/s1