3-[[(4-bromanyl-2,6-dimethyl-phenyl)amino]methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[[(4-bromanyl-2,6-dimethyl-phenyl)amino]methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(4-bromo-2,6-dimethyl-anilino)methyl]-4-fluoro-benzonitrile CAS Name: 3-[(4-bromo-2,6-dimethylanilino)methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(4-bromo-2,6-dimethylanilino)methyl]-4-fluorobenzonitrile Traditional Name: 3-[(4-bromo-2,6-dimethyl-anilino)methyl]-4-fluoro-benzonitrile Formula: C16H14BrFN2 MolecularWeight: 333.198163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NCC2=C(C=CC(=C2)C#N)F)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NCC2=C(C=CC(=C2)C#N)F)C)Br

InChI

InChI=1S/C16H14BrFN2/c1-10-5-14(17)6-11(2)16(10)20-9-13-7-12(8-19)3-4-15(13)18/h3-7,20H,9H2,1-2H3