[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-(2,5-difluorophenyl)-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-(2,5-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluorophenyl)-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-(2,5-difluorophenyl)-2-keto-ethyl] ester Formula: C13H7F2NO5S MolecularWeight: 327.260186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1F)C(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F

InChI

InChI=1S/C13H7F2NO5S/c14-7-1-2-9(15)8(5-7)10(17)6-21-13(18)11-3-4-12(22-11)16(19)20/h1-5H,6H2