methyl (4Z)-4-[(5-bromanyl-2-methoxy-phenyl)methylidene]-1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(5-bromanyl-2-methoxy-phenyl)methylidene]-1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(5-bromo-2-methoxy-phenyl)methylene]-1-(3-chloro-4-fluoro-phenyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-chloro-4-fluorophenyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-chloro-4-fluorophenyl)-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(5-bromo-2-methoxy-benzylidene)-1-(3-chloro-4-fluoro-phenyl)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H16BrClFNO4 MolecularWeight: 480.711443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(C=CC(=C2)Br)OC)C(=O)N1C3=CC(=C(C=C3)F)Cl)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=C(C=CC(=C2)Br)OC)/C(=O)N1C3=CC(=C(C=C3)F)Cl)C(=O)OC

InChI

InChI=1S/C21H16BrClFNO4/c1-11-19(21(27)29-3)15(9-12-8-13(22)4-7-18(12)28-2)20(26)25(11)14-5-6-17(24)16(23)10-14/h4-10H,1-3H3/b15-9-