(phenylmethyl) (2E)-2-[[(4-fluorophenyl)amino]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (2E)-2-[[(4-fluorophenyl)amino]methylidene]-3-oxidanylidene-butanoate Openeye Name: benzyl (2E)-2-[(4-fluoroanilino)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(4-fluoroanilino)methylidene]-3-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E)-2-[(4-fluoroanilino)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(4-fluoroanilino)acrylic acid benzyl ester Formula: C18H16FNO3 MolecularWeight: 313.322943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC1=CC=C(C=C1)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)/C(=C\NC1=CC=C(C=C1)F)/C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H16FNO3/c1-13(21)17(11-20-16-9-7-15(19)8-10-16)18(22)23-12-14-5-3-2-4-6-14/h2-11,20H,12H2,1H3/b17-11+