ethyl 8-cyano-7-(4-fluorophenyl)-1-methyl-4-oxidanylidene-pyrrolo[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 8-cyano-7-(4-fluorophenyl)-1-methyl-4-oxidanylidene-pyrrolo[1,2-a]pyrimidine-3-carboxylate Openeye Name: ethyl 8-cyano-7-(4-fluorophenyl)-1-methyl-4-oxo-pyrrolo[1,2-a]pyrimidine-3-carboxylate CAS Name: 8-cyano-7-(4-fluorophenyl)-1-methyl-4-oxo-3-pyrrolo[1,2-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-cyano-7-(4-fluorophenyl)-1-methyl-4-oxopyrrolo[1,2-a]pyrimidine-3-carboxylate Traditional Name: 8-cyano-7-(4-fluorophenyl)-4-keto-1-methyl-pyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C18H14FN3O3 MolecularWeight: 339.320463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=CN2C1=O)C3=CC=C(C=C3)F)C#N)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=CN2C1=O)C3=CC=C(C=C3)F)C#N)C

InChI

InChI=1S/C18H14FN3O3/c1-3-25-18(24)15-9-21(2)16-13(8-20)14(10-22(16)17(15)23)11-4-6-12(19)7-5-11/h4-7,9-10H,3H2,1-2H3