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

Systemtic Name: ethyl 6-bromanyl-2-(2-chloranylethanoylamino)-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(2-chloroacetyl)amino]-7-oxo-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 6-bromo-2-[(2-chloro-1-oxoethyl)amino]-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(2-chloroacetyl)amino]-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 6-bromo-2-[(2-chloroacetyl)amino]-7-keto-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C13H13BrClNO4S MolecularWeight: 394.66862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrClNO4S/c1-2-20-13(19)9-6-3-4-7(14)10(18)11(6)21-12(9)16-8(17)5-15/h7H,2-5H2,1H3,(H,16,17)