[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluorophenyl)-2-oxoethyl] 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid [2-(3,4-difluorophenyl)-2-keto-ethyl] ester Formula: C14H10F2N2O5 MolecularWeight: 324.236406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC(=O)C2=CC(=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC(=O)C2=CC(=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F2N2O5/c1-17-6-9(18(21)22)5-12(17)14(20)23-7-13(19)8-2-3-10(15)11(16)4-8/h2-6H,7H2,1H3