2-(3-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(3-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(m-tolyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-(3-methylphenyl)-N-[4-(1-piperidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(3-methylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(m-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=C1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O/c1-17-6-5-7-19(14-17)15-21(24)22-20-10-8-18(9-11-20)16-23-12-3-2-4-13-23/h5-11,14H,2-4,12-13,15-16H2,1H3,(H,22,24)/p+1