N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine

Systemtic Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine Openeye Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolyl]propane-1,3-diamine CAS Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolinyl]propane-1,3-diamine IUPAC Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine Traditional Name: [2,8-bis(trifluoromethyl)-4-quinolyl]-[3-[[2,8-bis(trifluoromethyl)-4-quinolyl]amino]propyl]amine Formula: C25H16F12N4 MolecularWeight: 600.402178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2NCCCNC3=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=C2NCCCNC3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H16F12N4/c26-22(27,28)14-6-1-4-12-16(10-18(24(32,33)34)40-20(12)14)38-8-3-9-39-17-11-19(25(35,36)37)41-21-13(17)5-2-7-15(21)23(29,30)31/h1-2,4-7,10-11H,3,8-9H2,(H,38,40)(H,39,41)