N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]nonane-1,9-diamine

Systemtic Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]nonane-1,9-diamine Openeye Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolyl]nonane-1,9-diamine CAS Name: N,N'-bis[2,8-bis(trifluoromethyl)-4-quinolinyl]nonane-1,9-diamine IUPAC Name: N,N'-bis[2,8-bis(trifluoromethyl)quinolin-4-yl]nonane-1,9-diamine Traditional Name: [2,8-bis(trifluoromethyl)-4-quinolyl]-[9-[[2,8-bis(trifluoromethyl)-4-quinolyl]amino]nonyl]amine Formula: C31H28F12N4 MolecularWeight: 684.561658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2NCCCCCCCCCNC3=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=C2NCCCCCCCCCNC3=CC(=NC4=C3C=CC=C4C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C31H28F12N4/c32-28(33,34)20-12-8-10-18-22(16-24(30(38,39)40)46-26(18)20)44-14-6-4-2-1-3-5-7-15-45-23-17-25(31(41,42)43)47-27-19(23)11-9-13-21(27)29(35,36)37/h8-13,16-17H,1-7,14-15H2,(H,44,46)(H,45,47)