2-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 3-[4-(4-fluorobenzyl)oxy-3-methoxy-phenyl]-2-pivaloyl-acrylonitrile Formula: C22H22FNO3 MolecularWeight: 367.413383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)OC)C#N

Isomeric SMILES

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)OC)C#N

InChI

InChI=1S/C22H22FNO3/c1-22(2,3)21(25)17(13-24)11-16-7-10-19(20(12-16)26-4)27-14-15-5-8-18(23)9-6-15/h5-12H,14H2,1-4H3