2-(2,4-dimethylquinolin-3-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]ethanone

Systemtic Name: 2-(2,4-dimethylquinolin-3-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]ethanone Openeye Name: 2-(2,4-dimethyl-3-quinolyl)-1-[2-(isopropylamino)pyridin-1-ium-1-yl]ethanone CAS Name: 2-(2,4-dimethyl-3-quinolinyl)-1-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]ethanone IUPAC Name: 2-(2,4-dimethylquinolin-3-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]ethanone Traditional Name: 2-(2,4-dimethyl-3-quinolyl)-1-[2-(isopropylamino)pyridin-1-ium-1-yl]ethanone Formula: C21H24N3O+ MolecularWeight: 334.43476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)[N+]3=CC=CC=C3NC(C)C

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)[N+]3=CC=CC=C3NC(C)C

InChI

InChI=1S/C21H23N3O/c1-14(2)22-20-11-7-8-12-24(20)21(25)13-18-15(3)17-9-5-6-10-19(17)23-16(18)4/h5-12,14H,13H2,1-4H3/p+1