methyl 5-ethoxy-6-oxidanyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-ethoxy-6-oxidanyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-ethoxy-6-hydroxy-benzothiophene-2-carboxylate CAS Name: 5-ethoxy-6-hydroxy-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-ethoxy-6-hydroxy-1-benzothiophene-2-carboxylate Traditional Name: 5-ethoxy-6-hydroxy-benzothiophene-2-carboxylic acid methyl ester Formula: C12H12O4S MolecularWeight: 252.28628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C=C(S2)C(=O)OC)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C=C(S2)C(=O)OC)O

InChI

InChI=1S/C12H12O4S/c1-3-16-9-4-7-5-11(12(14)15-2)17-10(7)6-8(9)13/h4-6,13H,3H2,1-2H3