N4-[5-[4-fluoranyl-3-(trifluoromethyl)phenoxy]-6-methoxy-quinolin-8-yl]pentane-1,4-diamine

Systemtic Name: N4-[5-[4-fluoranyl-3-(trifluoromethyl)phenoxy]-6-methoxy-quinolin-8-yl]pentane-1,4-diamine Openeye Name: N4-[5-[4-fluoro-3-(trifluoromethyl)phenoxy]-6-methoxy-8-quinolyl]pentane-1,4-diamine CAS Name: N4-[5-[4-fluoro-3-(trifluoromethyl)phenoxy]-6-methoxy-8-quinolinyl]pentane-1,4-diamine IUPAC Name: 4-N-[5-[4-fluoro-3-(trifluoromethyl)phenoxy]-6-methoxyquinolin-8-yl]pentane-1,4-diamine Traditional Name: (4-amino-1-methyl-butyl)-[5-[4-fluoro-3-(trifluoromethyl)phenoxy]-6-methoxy-8-quinolyl]amine Formula: C22H23F4N3O2 MolecularWeight: 437.430533

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN)NC1=CC(=C(C2=C1N=CC=C2)OC3=CC(=C(C=C3)F)C(F)(F)F)OC

Isomeric SMILES

CC(CCCN)NC1=CC(=C(C2=C1N=CC=C2)OC3=CC(=C(C=C3)F)C(F)(F)F)OC

InChI

InChI=1S/C22H23F4N3O2/c1-13(5-3-9-27)29-18-12-19(30-2)21(15-6-4-10-28-20(15)18)31-14-7-8-17(23)16(11-14)22(24,25)26/h4,6-8,10-13,29H,3,5,9,27H2,1-2H3