2-[[6-chloranyl-3-methyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[6-chloranyl-3-methyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[6-chloro-3-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[6-chloro-3-methyl-2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[6-chloro-3-methyl-2-(4-methylphenyl)quinoline-4-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[6-chloro-3-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C22H25ClN3O+ MolecularWeight: 382.9064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)NCC[NH+](C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)NCC[NH+](C)C)C

InChI

InChI=1S/C22H24ClN3O/c1-14-5-7-16(8-6-14)21-15(2)20(22(27)24-11-12-26(3)4)18-13-17(23)9-10-19(18)25-21/h5-10,13H,11-12H2,1-4H3,(H,24,27)/p+1