[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-nitro-benzoate

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-nitro-benzoate Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl] 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid [2-(4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl] 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid [2-(4-fluoroanilino)-2-keto-ethyl] ester Formula: C15H12FN3O5 MolecularWeight: 333.271283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12FN3O5/c16-9-1-3-10(4-2-9)18-14(20)8-24-15(21)12-7-11(19(22)23)5-6-13(12)17/h1-7H,8,17H2,(H,18,20)