ethyl 2-acetamido-6,6-bis(bromanyl)-7-oxidanylidene-4,5-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-acetamido-6,6-bis(bromanyl)-7-oxidanylidene-4,5-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-acetamido-6,6-dibromo-7-oxo-4,5-dihydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-6,6-dibromo-7-oxo-4,5-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetamido-6,6-dibromo-7-oxo-4,5-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-6,6-dibromo-7-keto-4,5-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C13H13Br2NO4S MolecularWeight: 439.11962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2=O)(Br)Br)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2=O)(Br)Br)NC(=O)C

InChI

InChI=1S/C13H13Br2NO4S/c1-3-20-12(19)8-7-4-5-13(14,15)10(18)9(7)21-11(8)16-6(2)17/h3-5H2,1-2H3,(H,16,17)