ethyl 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethyl-imidazole-4-carboxylate

Systemtic Name: ethyl 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethyl-imidazole-4-carboxylate Openeye Name: ethyl 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethyl-imidazole-4-carboxylate CAS Name: 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethylimidazole-4-carboxylate Traditional Name: 2-[2-(2-fluorophenyl)ethynyl]-3,5-dimethyl-imidazole-4-carboxylic acid ethyl ester Formula: C16H15FN2O2 MolecularWeight: 286.300903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1C)C#CC2=CC=CC=C2F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1C)C#CC2=CC=CC=C2F)C

InChI

InChI=1S/C16H15FN2O2/c1-4-21-16(20)15-11(2)18-14(19(15)3)10-9-12-7-5-6-8-13(12)17/h5-8H,4H2,1-3H3