2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]acetamide Formula: C23H30ClN2O2+ MolecularWeight: 401.9495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)COC2=CC(=C(C=C2)Cl)C)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC(=C(C=C2)Cl)C)[NH+]3CCCCC3

InChI

InChI=1S/C23H29ClN2O2/c1-17-6-8-19(9-7-17)22(26-12-4-3-5-13-26)15-25-23(27)16-28-20-10-11-21(24)18(2)14-20/h6-11,14,22H,3-5,12-13,15-16H2,1-2H3,(H,25,27)/p+1/t22-/m0/s1