[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-(7-methoxy-2-methyl-quinolin-3-yl)methanone

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-(7-methoxy-2-methyl-quinolin-3-yl)methanone Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-4-ium-1-yl]-(7-methoxy-2-methyl-3-quinolyl)methanone CAS Name: [4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazin-4-iumyl]-(7-methoxy-2-methyl-3-quinolinyl)methanone IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(7-methoxy-2-methylquinolin-3-yl)methanone Traditional Name: [4-(2-chloro-6-fluoro-benzyl)piperazin-4-ium-1-yl]-(7-methoxy-2-methyl-3-quinolyl)methanone Formula: C23H24ClFN3O2+ MolecularWeight: 428.906963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)N3CC[NH+](CC3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)N3CC[NH+](CC3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H23ClFN3O2/c1-15-18(12-16-6-7-17(30-2)13-22(16)26-15)23(29)28-10-8-27(9-11-28)14-19-20(24)4-3-5-21(19)25/h3-7,12-13H,8-11,14H2,1-2H3/p+1