4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)quinoline-3-carbonitrile Formula: C16H9ClFN3 MolecularWeight: 297.714163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClFN3/c17-13-7-11(5-6-14(13)18)21-16-10(8-19)9-20-15-4-2-1-3-12(15)16/h1-7,9H,(H,20,21)