N4-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-1-(7-chloranylquinolin-4-yl)cyclohexane-1,4-diamine

Systemtic Name: N4-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-1-(7-chloranylquinolin-4-yl)cyclohexane-1,4-diamine Openeye Name: N4-[(4-chloro-3-fluoro-phenyl)methyl]-1-(7-chloro-4-quinolyl)cyclohexane-1,4-diamine CAS Name: N4-[(4-chloro-3-fluorophenyl)methyl]-1-(7-chloro-4-quinolinyl)cyclohexane-1,4-diamine IUPAC Name: 4-N-[(4-chloro-3-fluorophenyl)methyl]-1-(7-chloroquinolin-4-yl)cyclohexane-1,4-diamine Traditional Name: [4-amino-4-(7-chloro-4-quinolyl)cyclohexyl]-(4-chloro-3-fluoro-benzyl)amine Formula: C22H22Cl2FN3 MolecularWeight: 418.334583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC2=CC(=C(C=C2)Cl)F)(C3=C4C=CC(=CC4=NC=C3)Cl)N

Isomeric SMILES

C1CC(CCC1NCC2=CC(=C(C=C2)Cl)F)(C3=C4C=CC(=CC4=NC=C3)Cl)N

InChI

InChI=1S/C22H22Cl2FN3/c23-15-2-3-17-18(7-10-27-21(17)12-15)22(26)8-5-16(6-9-22)28-13-14-1-4-19(24)20(25)11-14/h1-4,7,10-12,16,28H,5-6,8-9,13,26H2