methyl 4-ethanoyl-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 4-ethanoyl-1-benzothiophene-3-carboxylate Openeye Name: methyl 4-acetylbenzothiophene-3-carboxylate CAS Name: 4-acetyl-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 4-acetyl-1-benzothiophene-3-carboxylate Traditional Name: 4-acetylbenzothiophene-3-carboxylic acid methyl ester Formula: C12H10O3S MolecularWeight: 234.271

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C(=CC=C1)SC=C2C(=O)OC

Isomeric SMILES

CC(=O)C1=C2C(=CC=C1)SC=C2C(=O)OC

InChI

InChI=1S/C12H10O3S/c1-7(13)8-4-3-5-10-11(8)9(6-16-10)12(14)15-2/h3-6H,1-2H3