ethyl 4-cyano-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-cyanobenzothiophene-2-carboxylate CAS Name: 4-cyano-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-1-benzothiophene-2-carboxylate Traditional Name: 4-cyanobenzothiophene-2-carboxylic acid ethyl ester Formula: C12H9NO2S MolecularWeight: 231.27036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CC=C2S1)C#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CC=C2S1)C#N

InChI

InChI=1S/C12H9NO2S/c1-2-15-12(14)11-6-9-8(7-13)4-3-5-10(9)16-11/h3-6H,2H2,1H3