ethyl 2-(3-bromanylpropanoylamino)-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(3-bromanylpropanoylamino)-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(3-bromopropanoylamino)-7-oxo-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-[(3-bromo-1-oxopropyl)amino]-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-bromopropanoylamino)-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 2-(3-bromopropanoylamino)-7-keto-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C14H16BrNO4S MolecularWeight: 374.25014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)CCBr

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)CCBr

InChI

InChI=1S/C14H16BrNO4S/c1-2-20-14(19)11-8-4-3-5-9(17)12(8)21-13(11)16-10(18)6-7-15/h2-7H2,1H3,(H,16,18)