2-cyanoethyl (2E)-2-[[3,4-bis(fluoranyl)phenyl]methylidene]-4-methoxy-3-oxidanylidene-butanoate

Systemtic Name: 2-cyanoethyl (2E)-2-[[3,4-bis(fluoranyl)phenyl]methylidene]-4-methoxy-3-oxidanylidene-butanoate Openeye Name: 2-cyanoethyl (2E)-2-[(3,4-difluorophenyl)methylene]-4-methoxy-3-oxo-butanoate CAS Name: (2E)-2-[(3,4-difluorophenyl)methylidene]-4-methoxy-3-oxobutanoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (2E)-2-[(3,4-difluorophenyl)methylidene]-4-methoxy-3-oxobutanoate Traditional Name: (E)-3-(3,4-difluorophenyl)-2-(2-methoxyacetyl)acrylic acid 2-cyanoethyl ester Formula: C15H13F2NO4 MolecularWeight: 309.264826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)C(=CC1=CC(=C(C=C1)F)F)C(=O)OCCC#N

Isomeric SMILES

COCC(=O)/C(=C\C1=CC(=C(C=C1)F)F)/C(=O)OCCC#N

InChI

InChI=1S/C15H13F2NO4/c1-21-9-14(19)11(15(20)22-6-2-5-18)7-10-3-4-12(16)13(17)8-10/h3-4,7-8H,2,6,9H2,1H3/b11-7+