N5-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]hexane-1,5-diamine

Systemtic Name: N5-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]hexane-1,5-diamine Openeye Name: N5-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]hexane-1,5-diamine CAS Name: N5-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolinyl]hexane-1,5-diamine IUPAC Name: 5-N-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]hexane-1,5-diamine Traditional Name: (5-amino-1-methyl-pentyl)-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]amine Formula: C24H28F3N3O2 MolecularWeight: 447.49323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C(C2=NC=C1)NC(C)CCCCN)OC)OC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C2C(=C(C=C(C2=NC=C1)NC(C)CCCCN)OC)OC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C24H28F3N3O2/c1-15-10-12-29-22-19(30-16(2)7-4-5-11-28)14-20(31-3)23(21(15)22)32-18-9-6-8-17(13-18)24(25,26)27/h6,8-10,12-14,16,30H,4-5,7,11,28H2,1-3H3