(3-cyanophenyl) 5-bromanylthiophene-2-carboxylate

Systemtic Name: (3-cyanophenyl) 5-bromanylthiophene-2-carboxylate Openeye Name: (3-cyanophenyl) 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid (3-cyanophenyl) ester Formula: C12H6BrNO2S MolecularWeight: 308.15054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC=C(S2)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OC(=O)C2=CC=C(S2)Br)C#N

InChI

InChI=1S/C12H6BrNO2S/c13-11-5-4-10(17-11)12(15)16-9-3-1-2-8(6-9)7-14/h1-6H