3-[[(3,4-dimethoxyphenyl)amino]methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[[(3,4-dimethoxyphenyl)amino]methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(3,4-dimethoxyanilino)methyl]-4-fluoro-benzonitrile CAS Name: 3-[(3,4-dimethoxyanilino)methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(3,4-dimethoxyanilino)methyl]-4-fluorobenzonitrile Traditional Name: 3-[(3,4-dimethoxyanilino)methyl]-4-fluoro-benzonitrile Formula: C16H15FN2O2 MolecularWeight: 286.300903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=C(C=CC(=C2)C#N)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=C(C=CC(=C2)C#N)F)OC

InChI

InChI=1S/C16H15FN2O2/c1-20-15-6-4-13(8-16(15)21-2)19-10-12-7-11(9-18)3-5-14(12)17/h3-8,19H,10H2,1-2H3