N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,3-dimethyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide Formula: C19H25N2O+ MolecularWeight: 297.4146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O/c1-5-14(2)17-8-10-18(11-9-17)20-19(22)13-21-12-6-7-15(3)16(21)4/h6-12,14H,5,13H2,1-4H3/p+1/t14-/m0/s1