3-fluoranyl-4-[[(4-propan-2-ylphenyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[[(4-propan-2-ylphenyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(4-isopropylanilino)methyl]benzonitrile CAS Name: 3-fluoro-4-[(4-propan-2-ylanilino)methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(4-propan-2-ylanilino)methyl]benzonitrile Traditional Name: 4-(cumidinomethyl)-3-fluoro-benzonitrile Formula: C17H17FN2 MolecularWeight: 268.328683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C17H17FN2/c1-12(2)14-5-7-16(8-6-14)20-11-15-4-3-13(10-19)9-17(15)18/h3-9,12,20H,11H2,1-2H3