ethyl (2Z)-2-[(4-fluoranyl-3-phenoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: ethyl (2Z)-2-[(4-fluoranyl-3-phenoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-pentanoate Openeye Name: ethyl (2Z)-2-[(4-fluoro-3-phenoxy-phenyl)methylene]-4-methyl-3-oxo-pentanoate CAS Name: (2Z)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]-4-methyl-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]-4-methyl-3-oxopentanoate Traditional Name: (Z)-3-(4-fluoro-3-phenoxy-phenyl)-2-isobutyryl-acrylic acid ethyl ester Formula: C21H21FO4 MolecularWeight: 356.387443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)F)OC2=CC=CC=C2)C(=O)C(C)C

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC(=C(C=C1)F)OC2=CC=CC=C2)/C(=O)C(C)C

InChI

InChI=1S/C21H21FO4/c1-4-25-21(24)17(20(23)14(2)3)12-15-10-11-18(22)19(13-15)26-16-8-6-5-7-9-16/h5-14H,4H2,1-3H3/b17-12-