4-[4-[[4-bromanyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-quinoline-2-carboxamide

Systemtic Name: 4-[4-[[4-bromanyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-quinoline-2-carboxamide Openeye Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-quinoline-2-carboxamide CAS Name: 4-[4-[[[4-bromo-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenoxy]-N-methyl-2-quinolinecarboxamide IUPAC Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methylquinoline-2-carboxamide Traditional Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-quinaldamide Formula: C25H18BrF3N4O3 MolecularWeight: 559.33463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC2=CC=CC=C2C(=C1)OC3=CC=C(C=C3)NC(=O)NC4=CC(=C(C=C4)Br)C(F)(F)F

Isomeric SMILES

CNC(=O)C1=NC2=CC=CC=C2C(=C1)OC3=CC=C(C=C3)NC(=O)NC4=CC(=C(C=C4)Br)C(F)(F)F

InChI

InChI=1S/C25H18BrF3N4O3/c1-30-23(34)21-13-22(17-4-2-3-5-20(17)33-21)36-16-9-6-14(7-10-16)31-24(35)32-15-8-11-19(26)18(12-15)25(27,28)29/h2-13H,1H3,(H,30,34)(H2,31,32,35)