ethyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2,6-difluorobenzoyl)amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[(2,6-difluorophenyl)-oxomethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,6-difluorobenzoyl)amino]-5-nitrothiophene-3-carboxylate Traditional Name: 2-[(2,6-difluorobenzoyl)amino]-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C14H10F2N2O5S MolecularWeight: 356.301406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C14H10F2N2O5S/c1-2-23-14(20)7-6-10(18(21)22)24-13(7)17-12(19)11-8(15)4-3-5-9(11)16/h3-6H,2H2,1H3,(H,17,19)