ethyl (2E)-2-[[(3-chloranyl-4-fluoranyl-phenyl)amino]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-2-[[(3-chloranyl-4-fluoranyl-phenyl)amino]methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-2-[(3-chloro-4-fluoro-anilino)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(3-chloro-4-fluoroanilino)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(3-chloro-4-fluoroanilino)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(3-chloro-4-fluoro-anilino)acrylic acid ethyl ester Formula: C13H13ClFNO3 MolecularWeight: 285.698623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1)F)Cl)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC(=C(C=C1)F)Cl)/C(=O)C

InChI

InChI=1S/C13H13ClFNO3/c1-3-19-13(18)10(8(2)17)7-16-9-4-5-12(15)11(14)6-9/h4-7,16H,3H2,1-2H3/b10-7+