[2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-(3,4-difluoroanilino)-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-(3,4-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluoroanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-(3,4-difluoroanilino)-2-keto-ethyl] ester Formula: C13H8F2N2O5S MolecularWeight: 342.274826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-])F)F

InChI

InChI=1S/C13H8F2N2O5S/c14-8-2-1-7(5-9(8)15)16-11(18)6-22-13(19)10-3-4-12(23-10)17(20)21/h1-5H,6H2,(H,16,18)