[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-4-nitro-benzoate Openeye Name: [2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C15H9ClFN3O7 MolecularWeight: 397.699263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClFN3O7/c16-11-6-9(19(23)24)2-3-10(11)15(22)27-7-14(21)18-8-1-4-12(17)13(5-8)20(25)26/h1-6H,7H2,(H,18,21)