4-[(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)amino]-6,7,8-trimethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)amino]-6,7,8-trimethoxy-quinoline-3-carbonitrile Openeye Name: 4-(4-chloro-2-fluoro-5-hydroxy-anilino)-6,7,8-trimethoxy-quinoline-3-carbonitrile CAS Name: 4-(4-chloro-2-fluoro-5-hydroxyanilino)-6,7,8-trimethoxy-3-quinolinecarbonitrile IUPAC Name: 4-(4-chloro-2-fluoro-5-hydroxyanilino)-6,7,8-trimethoxyquinoline-3-carbonitrile Traditional Name: 4-(4-chloro-2-fluoro-5-hydroxy-anilino)-6,7,8-trimethoxy-quinoline-3-carbonitrile Formula: C19H15ClFN3O4 MolecularWeight: 403.791503

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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=C3F)Cl)O)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3F)Cl)O)OC)OC

InChI

InChI=1S/C19H15ClFN3O4/c1-26-15-4-10-16(24-13-6-14(25)11(20)5-12(13)21)9(7-22)8-23-17(10)19(28-3)18(15)27-2/h4-6,8,25H,1-3H3,(H,23,24)