N-methyl-4-phenyl-N-(2-pyridin-1-ium-2-ylethyl)benzamide

Systemtic Name: N-methyl-4-phenyl-N-(2-pyridin-1-ium-2-ylethyl)benzamide Openeye Name: N-methyl-4-phenyl-N-(2-pyridin-1-ium-2-ylethyl)benzamide CAS Name: N-methyl-4-phenyl-N-[2-(2-pyridin-1-iumyl)ethyl]benzamide IUPAC Name: N-methyl-4-phenyl-N-(2-pyridin-1-ium-2-ylethyl)benzamide Traditional Name: N-methyl-4-phenyl-N-(2-pyridin-1-ium-2-ylethyl)benzamide Formula: C21H21N2O+ MolecularWeight: 317.40424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=[NH+]1)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC=CC=[NH+]1)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O/c1-23(16-14-20-9-5-6-15-22-20)21(24)19-12-10-18(11-13-19)17-7-3-2-4-8-17/h2-13,15H,14,16H2,1H3/p+1