6-azanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-(trifluoromethyloxy)quinoline-3-carbonitrile

Systemtic Name: 6-azanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-(trifluoromethyloxy)quinoline-3-carbonitrile Openeye Name: 6-amino-4-(3-chloro-4-fluoro-anilino)-7-(trifluoromethoxy)quinoline-3-carbonitrile CAS Name: 6-amino-4-(3-chloro-4-fluoroanilino)-7-(trifluoromethoxy)-3-quinolinecarbonitrile IUPAC Name: 6-amino-4-(3-chloro-4-fluoroanilino)-7-(trifluoromethoxy)quinoline-3-carbonitrile Traditional Name: 6-amino-4-(3-chloro-4-fluoro-anilino)-7-(trifluoromethoxy)quinoline-3-carbonitrile Formula: C17H9ClF4N4O MolecularWeight: 396.726173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=NC3=CC(=C(C=C32)N)OC(F)(F)F)C#N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=NC3=CC(=C(C=C32)N)OC(F)(F)F)C#N)Cl)F

InChI

InChI=1S/C17H9ClF4N4O/c18-11-3-9(1-2-12(11)19)26-16-8(6-23)7-25-14-5-15(27-17(20,21)22)13(24)4-10(14)16/h1-5,7H,24H2,(H,25,26)