2-(2-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(2-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(o-tolyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-(2-methylphenyl)-N-[4-(1-piperidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(2-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(o-tolyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C21H27N2O+ MolecularWeight: 323.45188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O/c1-17-7-3-4-8-19(17)15-21(24)22-20-11-9-18(10-12-20)16-23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-16H2,1H3,(H,22,24)/p+1