methyl 5-(2,2-dicyanoethenyl)-1-(4-fluorophenyl)pyrrole-2-carboxylate

Systemtic Name: methyl 5-(2,2-dicyanoethenyl)-1-(4-fluorophenyl)pyrrole-2-carboxylate Openeye Name: methyl 5-(2,2-dicyanovinyl)-1-(4-fluorophenyl)pyrrole-2-carboxylate CAS Name: 5-(2,2-dicyanoethenyl)-1-(4-fluorophenyl)-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2,2-dicyanoethenyl)-1-(4-fluorophenyl)pyrrole-2-carboxylate Traditional Name: 5-(2,2-dicyanovinyl)-1-(4-fluorophenyl)pyrrole-2-carboxylic acid methyl ester Formula: C16H10FN3O2 MolecularWeight: 295.267903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(N1C2=CC=C(C=C2)F)C=C(C#N)C#N

Isomeric SMILES

COC(=O)C1=CC=C(N1C2=CC=C(C=C2)F)C=C(C#N)C#N

InChI

InChI=1S/C16H10FN3O2/c1-22-16(21)15-7-6-14(8-11(9-18)10-19)20(15)13-4-2-12(17)3-5-13/h2-8H,1H3