methyl (4E)-4-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-phenethyl-pyrrole-3-carboxylate

Systemtic Name: methyl (4E)-4-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-phenethyl-pyrrole-3-carboxylate Openeye Name: methyl (4E)-4-[(2-chloro-6-fluoro-phenyl)methylene]-2-methyl-5-oxo-1-phenethyl-pyrrole-3-carboxylate CAS Name: (4E)-4-[(2-chloro-6-fluorophenyl)methylidene]-2-methyl-5-oxo-1-phenethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4E)-4-[(2-chloro-6-fluorophenyl)methylidene]-2-methyl-5-oxo-1-phenethylpyrrole-3-carboxylate Traditional Name: (4E)-4-(2-chloro-6-fluoro-benzylidene)-5-keto-2-methyl-1-phenethyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C22H19ClFNO3 MolecularWeight: 399.842563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(C=CC=C2Cl)F)C(=O)N1CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C\C2=C(C=CC=C2Cl)F)/C(=O)N1CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H19ClFNO3/c1-14-20(22(27)28-2)17(13-16-18(23)9-6-10-19(16)24)21(26)25(14)12-11-15-7-4-3-5-8-15/h3-10,13H,11-12H2,1-2H3/b17-13+