4-[2-(9-oxidanylidenexanthen-2-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 4-[2-(9-oxidanylidenexanthen-2-yl)ethynyl]benzenecarbonitrile Openeye Name: 4-[2-(9-oxoxanthen-2-yl)ethynyl]benzonitrile CAS Name: 4-[2-(9-oxo-2-xanthenyl)ethynyl]benzonitrile IUPAC Name: 4-[2-(9-oxoxanthen-2-yl)ethynyl]benzonitrile Traditional Name: 4-[2-(9-ketoxanthen-2-yl)ethynyl]benzonitrile Formula: C22H11NO2 MolecularWeight: 321.32824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C#CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C#CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H11NO2/c23-14-17-9-6-15(7-10-17)5-8-16-11-12-21-19(13-16)22(24)18-3-1-2-4-20(18)25-21/h1-4,6-7,9-13H