3-[2-(6,6-dimethyl-5-oxidanylidene-7,8-dihydroquinolin-2-yl)ethynyl]-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[2-(6,6-dimethyl-5-oxidanylidene-7,8-dihydroquinolin-2-yl)ethynyl]-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[2-(6,6-dimethyl-5-oxo-7,8-dihydroquinolin-2-yl)ethynyl]-5-fluoro-benzonitrile CAS Name: 3-[2-(6,6-dimethyl-5-oxo-7,8-dihydroquinolin-2-yl)ethynyl]-5-fluorobenzonitrile IUPAC Name: 3-[2-(6,6-dimethyl-5-oxo-7,8-dihydroquinolin-2-yl)ethynyl]-5-fluorobenzonitrile Traditional Name: 3-fluoro-5-[2-(5-keto-6,6-dimethyl-7,8-dihydroquinolin-2-yl)ethynyl]benzonitrile Formula: C20H15FN2O MolecularWeight: 318.344303

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)C=CC(=N2)C#CC3=CC(=CC(=C3)F)C#N)C

Isomeric SMILES

CC1(CCC2=C(C1=O)C=CC(=N2)C#CC3=CC(=CC(=C3)F)C#N)C

InChI

InChI=1S/C20H15FN2O/c1-20(2)8-7-18-17(19(20)24)6-5-16(23-18)4-3-13-9-14(12-22)11-15(21)10-13/h5-6,9-11H,7-8H2,1-2H3