methyl 2-(2-bromanylethanoyl)-4,5-dihydro-1-benzothiophene-6-carboxylate

Systemtic Name: methyl 2-(2-bromanylethanoyl)-4,5-dihydro-1-benzothiophene-6-carboxylate Openeye Name: methyl 2-(2-bromoacetyl)-4,5-dihydrobenzothiophene-6-carboxylate CAS Name: 2-(2-bromo-1-oxoethyl)-4,5-dihydro-1-benzothiophene-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-bromoacetyl)-4,5-dihydro-1-benzothiophene-6-carboxylate Traditional Name: 2-(2-bromoacetyl)-4,5-dihydrobenzothiophene-6-carboxylic acid methyl ester Formula: C12H11BrO3S MolecularWeight: 315.18294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(CC1)C=C(S2)C(=O)CBr

Isomeric SMILES

COC(=O)C1=CC2=C(CC1)C=C(S2)C(=O)CBr

InChI

InChI=1S/C12H11BrO3S/c1-16-12(15)8-3-2-7-4-11(9(14)6-13)17-10(7)5-8/h4-5H,2-3,6H2,1H3