[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3,5-bis(fluoranyl)benzoate

Systemtic Name: [2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3,5-bis(fluoranyl)benzoate Openeye Name: [2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl] 3,5-difluorobenzoate CAS Name: 3,5-difluorobenzoic acid [2-(2-methyl-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-5-nitroanilino)-2-oxoethyl] 3,5-difluorobenzoate Traditional Name: 3,5-difluorobenzoic acid [2-keto-2-(2-methyl-5-nitro-anilino)ethyl] ester Formula: C16H12F2N2O5 MolecularWeight: 350.273686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC(=CC(=C2)F)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC(=CC(=C2)F)F

InChI

InChI=1S/C16H12F2N2O5/c1-9-2-3-13(20(23)24)7-14(9)19-15(21)8-25-16(22)10-4-11(17)6-12(18)5-10/h2-7H,8H2,1H3,(H,19,21)