methyl 7-methyl-3-oxidanylidene-1-benzothiophene-6-carboxylate

Systemtic Name: methyl 7-methyl-3-oxidanylidene-1-benzothiophene-6-carboxylate Openeye Name: methyl 7-methyl-3-oxo-benzothiophene-6-carboxylate CAS Name: 7-methyl-3-oxo-1-benzothiophene-6-carboxylic acid methyl ester IUPAC Name: methyl 7-methyl-3-oxo-1-benzothiophene-6-carboxylate Traditional Name: 3-keto-7-methyl-benzothiophene-6-carboxylic acid methyl ester Formula: C11H10O3S MolecularWeight: 222.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1SCC2=O)C(=O)OC

Isomeric SMILES

CC1=C(C=CC2=C1SCC2=O)C(=O)OC

InChI

InChI=1S/C11H10O3S/c1-6-7(11(13)14-2)3-4-8-9(12)5-15-10(6)8/h3-4H,5H2,1-2H3