(2S)-2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(4-methylphenyl)propanamide

Systemtic Name: (2S)-2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(4-methylphenyl)propanamide Openeye Name: (2S)-2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(p-tolyl)propanamide CAS Name: (2S)-2-(2,3-dimethyl-1-pyridin-1-iumyl)-N-(4-methylphenyl)propanamide IUPAC Name: (2S)-2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(4-methylphenyl)propanamide Traditional Name: (2S)-2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(p-tolyl)propionamide Formula: C17H21N2O+ MolecularWeight: 269.36144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)[N+]2=CC=CC(=C2C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)[N+]2=CC=CC(=C2C)C

InChI

InChI=1S/C17H20N2O/c1-12-7-9-16(10-8-12)18-17(20)15(4)19-11-5-6-13(2)14(19)3/h5-11,15H,1-4H3/p+1/t15-/m0/s1