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

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-nitro-7-(trifluoromethyloxy)quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-nitro-7-(trifluoromethoxy)quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-6-nitro-7-(trifluoromethoxy)-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-nitro-7-(trifluoromethoxy)quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-nitro-7-(trifluoromethoxy)quinoline-3-carbonitrile Formula: C17H7ClF4N4O3 MolecularWeight: 426.709093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=NC3=CC(=C(C=C32)[N+](=O)[O-])OC(F)(F)F)C#N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=NC3=CC(=C(C=C32)[N+](=O)[O-])OC(F)(F)F)C#N)Cl)F

InChI

InChI=1S/C17H7ClF4N4O3/c18-11-3-9(1-2-12(11)19)25-16-8(6-23)7-24-13-5-15(29-17(20,21)22)14(26(27)28)4-10(13)16/h1-5,7H,(H,24,25)