[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C13H8Br2O3S MolecularWeight: 404.07382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)C2=CC=C(S2)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)C2=CC=C(S2)Br)Br

InChI

InChI=1S/C13H8Br2O3S/c14-9-3-1-8(2-4-9)13(17)18-7-10(16)11-5-6-12(15)19-11/h1-6H,7H2