4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6,7-dimethoxy-quinoline-3-carbonitrile Openeye Name: 4-(4-bromo-2-fluoro-anilino)-6,7-dimethoxy-quinoline-3-carbonitrile CAS Name: 4-(4-bromo-2-fluoroanilino)-6,7-dimethoxy-3-quinolinecarbonitrile IUPAC Name: 4-(4-bromo-2-fluoroanilino)-6,7-dimethoxyquinoline-3-carbonitrile Traditional Name: 4-(4-bromo-2-fluoro-anilino)-6,7-dimethoxy-quinoline-3-carbonitrile Formula: C18H13BrFN3O2 MolecularWeight: 402.217123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrFN3O2/c1-24-16-6-12-15(7-17(16)25-2)22-9-10(8-21)18(12)23-14-4-3-11(19)5-13(14)20/h3-7,9H,1-2H3,(H,22,23)