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

Systemtic Name: 4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-methoxy-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide CAS Name: 4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-methoxy-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-methoxy-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O2/c1-17-6-8-18(9-7-17)21(24-14-4-3-5-15-24)16-23-22(25)19-10-12-20(26-2)13-11-19/h6-13,21H,3-5,14-16H2,1-2H3,(H,23,25)/p+1/t21-/m0/s1