4-[5-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanenitrile

Systemtic Name: 4-[5-fluoranyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanenitrile Openeye Name: 4-[5-fluoro-2-oxo-1-(4-pyridylmethyl)acenaphthylen-1-yl]butanenitrile CAS Name: 4-[5-fluoro-2-oxo-1-(pyridin-4-ylmethyl)-1-acenaphthylenyl]butanenitrile IUPAC Name: 4-[5-fluoro-2-oxo-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]butanenitrile Traditional Name: 4-[5-fluoro-2-keto-1-(4-pyridylmethyl)acenaphthen-1-yl]butyronitrile Formula: C22H17FN2O MolecularWeight: 344.381583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(C3=O)(CCCC#N)CC4=CC=NC=C4)F

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(C3=O)(CCCC#N)CC4=CC=NC=C4)F

InChI

InChI=1S/C22H17FN2O/c23-19-7-6-17-20-16(19)4-3-5-18(20)22(21(17)26,10-1-2-11-24)14-15-8-12-25-13-9-15/h3-9,12-13H,1-2,10,14H2