[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-chloranyl-2-oxidanyl-benzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-chloranyl-2-oxidanyl-benzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 4-chloro-2-hydroxy-benzoate CAS Name: 4-chloro-2-hydroxybenzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 4-chloro-2-hydroxybenzoate Traditional Name: 4-chloro-2-hydroxy-benzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C13H8BrClO4S MolecularWeight: 375.62222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)O)C(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

C1=CC(=C(C=C1Cl)O)C(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C13H8BrClO4S/c14-12-4-3-11(20-12)10(17)6-19-13(18)8-2-1-7(15)5-9(8)16/h1-5,16H,6H2