4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluorobenzonitrile Traditional Name: 4-[[2-(2,4-dichlorophenyl)ethylamino]methyl]-3-fluoro-benzonitrile Formula: C16H13Cl2FN2 MolecularWeight: 323.192223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)CNCCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)CNCCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H13Cl2FN2/c17-14-4-3-12(15(18)8-14)5-6-21-10-13-2-1-11(9-20)7-16(13)19/h1-4,7-8,21H,5-6,10H2