methyl 3-[2-(2-fluorophenyl)ethynyl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(2-fluorophenyl)ethynyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[2-(2-fluorophenyl)ethynyl]benzothiophene-2-carboxylate CAS Name: 3-[2-(2-fluorophenyl)ethynyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2-fluorophenyl)ethynyl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[2-(2-fluorophenyl)ethynyl]benzothiophene-2-carboxylic acid methyl ester Formula: C18H11FO2S MolecularWeight: 310.342143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)C#CC3=CC=CC=C3F

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)C#CC3=CC=CC=C3F

InChI

InChI=1S/C18H11FO2S/c1-21-18(20)17-14(13-7-3-5-9-16(13)22-17)11-10-12-6-2-4-8-15(12)19/h2-9H,1H3