N8-(5-azanylpentan-2-yl)-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]quinoline-4,8-diamine

Systemtic Name: N8-(5-azanylpentan-2-yl)-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]quinoline-4,8-diamine Openeye Name: N8-(4-amino-1-methyl-butyl)-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]quinoline-4,8-diamine CAS Name: N8-(5-aminopentan-2-yl)-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]quinoline-4,8-diamine IUPAC Name: 8-N-(5-aminopentan-2-yl)-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]quinoline-4,8-diamine Traditional Name: [4-amino-2,6-dimethoxy-5-[3-(trifluoromethyl)phenoxy]-8-quinolyl]-(4-amino-1-methyl-butyl)amine Formula: C23H27F3N4O3 MolecularWeight: 464.48069

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN)NC1=CC(=C(C2=C1N=C(C=C2N)OC)OC3=CC=CC(=C3)C(F)(F)F)OC

Isomeric SMILES

CC(CCCN)NC1=CC(=C(C2=C1N=C(C=C2N)OC)OC3=CC=CC(=C3)C(F)(F)F)OC

InChI

InChI=1S/C23H27F3N4O3/c1-13(6-5-9-27)29-17-12-18(31-2)22(20-16(28)11-19(32-3)30-21(17)20)33-15-8-4-7-14(10-15)23(24,25)26/h4,7-8,10-13,29H,5-6,9,27H2,1-3H3,(H2,28,30)