2-(2,3-dimethylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(2,3-dimethylphenoxy)-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2,3-dimethylphenoxy)-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(2,3-dimethylphenoxy)-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]acetamide Formula: C24H33N2O2+ MolecularWeight: 381.53102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)COC2=CC=CC(=C2C)C)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC=CC(=C2C)C)[NH+]3CCCCC3

InChI

InChI=1S/C24H32N2O2/c1-18-10-12-21(13-11-18)22(26-14-5-4-6-15-26)16-25-24(27)17-28-23-9-7-8-19(2)20(23)3/h7-13,22H,4-6,14-17H2,1-3H3,(H,25,27)/p+1/t22-/m0/s1