methyl (5E)-5-[(2-fluorophenyl)methylidene]-2-methyl-4-oxidanylidene-3H-pyrrole-3-carboxylate

Systemtic Name: methyl (5E)-5-[(2-fluorophenyl)methylidene]-2-methyl-4-oxidanylidene-3H-pyrrole-3-carboxylate Openeye Name: methyl (5E)-5-[(2-fluorophenyl)methylene]-2-methyl-4-oxo-3H-pyrrole-3-carboxylate CAS Name: (5E)-5-[(2-fluorophenyl)methylidene]-2-methyl-4-oxo-3H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (5E)-5-[(2-fluorophenyl)methylidene]-2-methyl-4-oxo-3H-pyrrole-3-carboxylate Traditional Name: (5E)-5-(2-fluorobenzylidene)-4-keto-2-methyl-1-pyrroline-3-carboxylic acid methyl ester Formula: C14H12FNO3 MolecularWeight: 261.248383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=CC=CC=C2F)C(=O)C1C(=O)OC

Isomeric SMILES

CC1=N/C(=C/C2=CC=CC=C2F)/C(=O)C1C(=O)OC

InChI

InChI=1S/C14H12FNO3/c1-8-12(14(18)19-2)13(17)11(16-8)7-9-5-3-4-6-10(9)15/h3-7,12H,1-2H3/b11-7+