3-chloranyl-4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3-chloranyl-4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide Formula: C22H28ClN2O2+ MolecularWeight: 387.92292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O2/c1-16-6-8-17(9-7-16)20(25-12-4-3-5-13-25)15-24-22(26)18-10-11-21(27-2)19(23)14-18/h6-11,14,20H,3-5,12-13,15H2,1-2H3,(H,24,26)/p+1/t20-/m0/s1