N-[(4-methoxyphenyl)methyl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(3S)-3-(trifluoromethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-p-anisyl-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Formula: C16H22F3N2O2+ MolecularWeight: 331.35329

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCCC(C2)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCC[C@@H](C2)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O2/c1-23-14-6-4-12(5-7-14)9-20-15(22)11-21-8-2-3-13(10-21)16(17,18)19/h4-7,13H,2-3,8-11H2,1H3,(H,20,22)/p+1/t13-/m0/s1