2-(2-chloranyl-6-fluoranyl-phenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(2-chloro-6-fluorophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2-chloro-6-fluorophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C22H27ClFN2O2+ MolecularWeight: 405.913383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CC2=C(C=CC=C2Cl)F)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)CC2=C(C=CC=C2Cl)F)[NH+]3CCCCC3

InChI

InChI=1S/C22H26ClFN2O2/c1-28-17-10-8-16(9-11-17)21(26-12-3-2-4-13-26)15-25-22(27)14-18-19(23)6-5-7-20(18)24/h5-11,21H,2-4,12-15H2,1H3,(H,25,27)/p+1/t21-/m0/s1