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

Systemtic Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]butane-1,4-diamine Openeye Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolyl]butane-1,4-diamine CAS Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolinyl]butane-1,4-diamine IUPAC Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]butane-1,4-diamine Traditional Name: [2,8-bis(trifluoromethyl)-4-quinolyl]-[4-[[2,8-bis(trifluoromethyl)-4-quinolyl]amino]butyl]amine Formula: C26H18F12N4 MolecularWeight: 614.428758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2NCCCCNC3=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=C2NCCCCNC3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H18F12N4/c27-23(28,29)15-7-3-5-13-17(11-19(25(33,34)35)41-21(13)15)39-9-1-2-10-40-18-12-20(26(36,37)38)42-22-14(18)6-4-8-16(22)24(30,31)32/h3-8,11-12H,1-2,9-10H2,(H,39,41)(H,40,42)