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

Systemtic Name: N4-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]hexane-1,4-diamine Openeye Name: N4-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]hexane-1,4-diamine CAS Name: N4-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]-8-quinolinyl]hexane-1,4-diamine IUPAC Name: 4-N-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]hexane-1,4-diamine Traditional Name: (4-amino-1-ethyl-butyl)-[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:

CCC(CCCN)NC1=CC(=C(C2=C(C=CN=C12)C)OC3=CC=CC(=C3)C(F)(F)F)OC

Isomeric SMILES

CCC(CCCN)NC1=CC(=C(C2=C(C=CN=C12)C)OC3=CC=CC(=C3)C(F)(F)F)OC

InChI

InChI=1S/C24H28F3N3O2/c1-4-17(8-6-11-28)30-19-14-20(31-3)23(21-15(2)10-12-29-22(19)21)32-18-9-5-7-16(13-18)24(25,26)27/h5,7,9-10,12-14,17,30H,4,6,8,11,28H2,1-3H3