4-[[4-fluoranyl-3-(trifluoromethyl)phenyl]amino]-6,7-dimethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[[4-fluoranyl-3-(trifluoromethyl)phenyl]amino]-6,7-dimethoxy-quinoline-3-carbonitrile Openeye Name: 4-[4-fluoro-3-(trifluoromethyl)anilino]-6,7-dimethoxy-quinoline-3-carbonitrile CAS Name: 4-[4-fluoro-3-(trifluoromethyl)anilino]-6,7-dimethoxy-3-quinolinecarbonitrile IUPAC Name: 4-[4-fluoro-3-(trifluoromethyl)anilino]-6,7-dimethoxyquinoline-3-carbonitrile Traditional Name: 4-[4-fluoro-3-(trifluoromethyl)anilino]-6,7-dimethoxy-quinoline-3-carbonitrile Formula: C19H13F4N3O2 MolecularWeight: 391.319033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3)F)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3)F)C(F)(F)F)OC

InChI

InChI=1S/C19H13F4N3O2/c1-27-16-6-12-15(7-17(16)28-2)25-9-10(8-24)18(12)26-11-3-4-14(20)13(5-11)19(21,22)23/h3-7,9H,1-2H3,(H,25,26)