3-[1-(4-fluorophenyl)-6,7-dimethoxy-3-oxidanylidene-1,4-dihydroisoquinolin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[1-(4-fluorophenyl)-6,7-dimethoxy-3-oxidanylidene-1,4-dihydroisoquinolin-2-yl]benzenecarbonitrile Openeye Name: 3-[1-(4-fluorophenyl)-6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]benzonitrile CAS Name: 3-[1-(4-fluorophenyl)-6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]benzonitrile IUPAC Name: 3-[1-(4-fluorophenyl)-6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]benzonitrile Traditional Name: 3-[1-(4-fluorophenyl)-3-keto-6,7-dimethoxy-1,4-dihydroisoquinolin-2-yl]benzonitrile Formula: C24H19FN2O3 MolecularWeight: 402.417663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=CC(=C3)C#N)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=CC(=C3)C#N)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C24H19FN2O3/c1-29-21-11-17-12-23(28)27(19-5-3-4-15(10-19)14-26)24(20(17)13-22(21)30-2)16-6-8-18(25)9-7-16/h3-11,13,24H,12H2,1-2H3