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

Systemtic Name: N4-[6-hexoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]pentane-1,4-diamine Openeye Name: N4-[6-hexoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]pentane-1,4-diamine CAS Name: N4-[6-hexoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolinyl]pentane-1,4-diamine IUPAC Name: 4-N-[6-hexoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]pentane-1,4-diamine Traditional Name: (4-amino-1-methyl-butyl)-[6-hexoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]amine Formula: C28H36F3N3O2 MolecularWeight: 503.59955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C2=C(C=CN=C2C(=C1)NC(C)CCCN)C)OC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCCCCCOC1=C(C2=C(C=CN=C2C(=C1)NC(C)CCCN)C)OC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C28H36F3N3O2/c1-4-5-6-7-16-35-24-18-23(34-20(3)10-9-14-32)26-25(19(2)13-15-33-26)27(24)36-22-12-8-11-21(17-22)28(29,30)31/h8,11-13,15,17-18,20,34H,4-7,9-10,14,16,32H2,1-3H3