4-[(2-fluoranyl-4-methyl-phenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 4-[(2-fluoranyl-4-methyl-phenyl)amino]quinoline-3-carbonitrile Openeye Name: 4-(2-fluoro-4-methyl-anilino)quinoline-3-carbonitrile CAS Name: 4-(2-fluoro-4-methylanilino)-3-quinolinecarbonitrile IUPAC Name: 4-(2-fluoro-4-methylanilino)quinoline-3-carbonitrile Traditional Name: 4-(2-fluoro-4-methyl-anilino)quinoline-3-carbonitrile Formula: C17H12FN3 MolecularWeight: 277.295683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N)F

InChI

InChI=1S/C17H12FN3/c1-11-6-7-16(14(18)8-11)21-17-12(9-19)10-20-15-5-3-2-4-13(15)17/h2-8,10H,1H3,(H,20,21)