2-(4-ethanoylphenoxy)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-ethanamide

Systemtic Name: 2-(4-ethanoylphenoxy)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-ethanamide Openeye Name: 2-(4-acetylphenoxy)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-acetamide CAS Name: 2-(4-acetylphenoxy)-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-N-phenethylacetamide IUPAC Name: 2-(4-acetylphenoxy)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethylacetamide Traditional Name: 2-(4-acetylphenoxy)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-acetamide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)N(CCC2=CC=CC=C2)CC3CCC[NH+](C3)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)N(CCC2=CC=CC=C2)C[C@H]3CCC[NH+](C3)C

InChI

InChI=1S/C25H32N2O3/c1-20(28)23-10-12-24(13-11-23)30-19-25(29)27(16-14-21-7-4-3-5-8-21)18-22-9-6-15-26(2)17-22/h3-5,7-8,10-13,22H,6,9,14-19H2,1-2H3/p+1/t22-/m0/s1