4-[4-(azetidin-1-ylmethyl)phenyl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(azetidin-1-ylmethyl)phenyl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(azetidin-1-ylmethyl)benzoyl]benzonitrile CAS Name: 4-[[4-(1-azetidinylmethyl)phenyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(azetidin-1-ylmethyl)benzoyl]benzonitrile Traditional Name: 4-[4-(azetidin-1-ylmethyl)benzoyl]benzonitrile Formula: C18H16N2O MolecularWeight: 276.33244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(C1)CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H16N2O/c19-12-14-2-6-16(7-3-14)18(21)17-8-4-15(5-9-17)13-20-10-1-11-20/h2-9H,1,10-11,13H2