4-[4-(2-phenylethynyl)phenyl]butanenitrile

Systemtic Name: 4-[4-(2-phenylethynyl)phenyl]butanenitrile Openeye Name: 4-[4-(2-phenylethynyl)phenyl]butanenitrile CAS Name: 4-[4-(2-phenylethynyl)phenyl]butanenitrile IUPAC Name: 4-[4-(2-phenylethynyl)phenyl]butanenitrile Traditional Name: 4-[4-(2-phenylethynyl)phenyl]butyronitrile Formula: C18H15N MolecularWeight: 245.3184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)CCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)CCCC#N

InChI

InChI=1S/C18H15N/c19-15-5-4-8-17-10-13-18(14-11-17)12-9-16-6-2-1-3-7-16/h1-3,6-7,10-11,13-14H,4-5,8H2