2-chloranyl-4-[[3-(cyanomethoxy)phenyl]methylamino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[[3-(cyanomethoxy)phenyl]methylamino]benzenecarbonitrile Openeye Name: 2-chloro-4-[[3-(cyanomethoxy)phenyl]methylamino]benzonitrile CAS Name: 2-chloro-4-[[3-(cyanomethoxy)phenyl]methylamino]benzonitrile IUPAC Name: 2-chloro-4-[[3-(cyanomethoxy)phenyl]methylamino]benzonitrile Traditional Name: 2-chloro-4-[[3-(cyanomethoxy)benzyl]amino]benzonitrile Formula: C16H12ClN3O MolecularWeight: 297.73898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)CNC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)CNC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H12ClN3O/c17-16-9-14(5-4-13(16)10-19)20-11-12-2-1-3-15(8-12)21-7-6-18/h1-5,8-9,20H,7,11H2