[6-chloranyl-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [6-chloranyl-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolinyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [6-chloro-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C24H27ClN3O+ MolecularWeight: 408.94368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=C(C=C(C=C4)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C24H26ClN3O/c1-4-27-9-11-28(12-10-27)24(29)21-15-23(19-7-5-16(2)13-17(19)3)26-22-8-6-18(25)14-20(21)22/h5-8,13-15H,4,9-12H2,1-3H3/p+1