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

Systemtic Name: 3-chloranyl-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-chloro-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide CAS Name: 3-chloro-N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-chloro-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-chloro-N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]benzamide Formula: C21H26ClN2O+ MolecularWeight: 357.89694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O/c1-16-8-10-17(11-9-16)20(24-12-3-2-4-13-24)15-23-21(25)18-6-5-7-19(22)14-18/h5-11,14,20H,2-4,12-13,15H2,1H3,(H,23,25)/p+1/t20-/m0/s1