(2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-ethanoylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-ethanoylphenyl)propanamide Openeye Name: (2R)-N-(3-acetylphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(3-acetylphenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]propanamide IUPAC Name: (2R)-N-(3-acetylphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(3-acetylphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propionamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C(=O)C)[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H21N3O2/c1-13(21-10-8-17(9-11-21)20(3)4)18(23)19-16-7-5-6-15(12-16)14(2)22/h5-13H,1-4H3/p+1/t13-/m1/s1