ethyl 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]imidazole-4-carboxylate

Systemtic Name: ethyl 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]imidazole-4-carboxylate Openeye Name: ethyl 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-oxo-ethyl]imidazole-4-carboxylate CAS Name: 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-oxoethyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-oxoethyl]imidazole-4-carboxylate Traditional Name: 1-(4-cyanophenyl)-5-[2-(4-fluorophenyl)-2-keto-ethyl]imidazole-4-carboxylic acid ethyl ester Formula: C21H16FN3O3 MolecularWeight: 377.368443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=N1)C2=CC=C(C=C2)C#N)CC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(N(C=N1)C2=CC=C(C=C2)C#N)CC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H16FN3O3/c1-2-28-21(27)20-18(11-19(26)15-5-7-16(22)8-6-15)25(13-24-20)17-9-3-14(12-23)4-10-17/h3-10,13H,2,11H2,1H3