[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methoxy]benzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methoxy]benzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 4-(difluoromethoxy)benzoate CAS Name: 4-(difluoromethoxy)benzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 4-(difluoromethoxy)benzoate Traditional Name: 4-(difluoromethoxy)benzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C14H9BrF2O4S MolecularWeight: 391.184666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrF2O4S/c15-12-6-5-11(22-12)10(18)7-20-13(19)8-1-3-9(4-2-8)21-14(16)17/h1-6,14H,7H2