N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]pentane-1,5-diamine

Systemtic Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]pentane-1,5-diamine Openeye Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolyl]pentane-1,5-diamine CAS Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolinyl]pentane-1,5-diamine IUPAC Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]pentane-1,5-diamine Traditional Name: [2,8-bis(trifluoromethyl)-4-quinolyl]-[5-[[2,8-bis(trifluoromethyl)-4-quinolyl]amino]pentyl]amine Formula: C27H20F12N4 MolecularWeight: 628.455338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2NCCCCCNC3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2NCCCCCNC3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H20F12N4/c28-24(29,30)16-8-4-6-14-18(12-20(26(34,35)36)42-22(14)16)40-10-2-1-3-11-41-19-13-21(27(37,38)39)43-23-15(19)7-5-9-17(23)25(31,32)33/h4-9,12-13H,1-3,10-11H2,(H,40,42)(H,41,43)