methyl 3-[(E)-2-(4-fluorophenyl)-4-imidazol-1-yl-but-1-enyl]benzoate

Systemtic Name: methyl 3-[(E)-2-(4-fluorophenyl)-4-imidazol-1-yl-but-1-enyl]benzoate Openeye Name: methyl 3-[(E)-2-(4-fluorophenyl)-4-imidazol-1-yl-but-1-enyl]benzoate CAS Name: 3-[(E)-2-(4-fluorophenyl)-4-(1-imidazolyl)but-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(E)-2-(4-fluorophenyl)-4-imidazol-1-ylbut-1-enyl]benzoate Traditional Name: 3-[(E)-2-(4-fluorophenyl)-4-imidazol-1-yl-but-1-enyl]benzoic acid methyl ester Formula: C21H19FN2O2 MolecularWeight: 350.386163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C=C(CCN2C=CN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)/C=C(\CCN2C=CN=C2)/C3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN2O2/c1-26-21(25)19-4-2-3-16(14-19)13-18(9-11-24-12-10-23-15-24)17-5-7-20(22)8-6-17/h2-8,10,12-15H,9,11H2,1H3/b18-13+