[1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(2-fluorophenyl)furan-2-carboxylate

Systemtic Name: [1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(2-fluorophenyl)furan-2-carboxylate Openeye Name: [2-(2-methoxy-5-nitro-anilino)-1-methyl-2-oxo-ethyl] 5-(2-fluorophenyl)furan-2-carboxylate CAS Name: 5-(2-fluorophenyl)-2-furancarboxylic acid [1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl] 5-(2-fluorophenyl)furan-2-carboxylate Traditional Name: 5-(2-fluorophenyl)furan-2-carboxylic acid [2-keto-2-(2-methoxy-5-nitro-anilino)-1-methyl-ethyl] ester Formula: C21H17FN2O7 MolecularWeight: 428.367283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)C2=CC=C(O2)C3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)C2=CC=C(O2)C3=CC=CC=C3F

InChI

InChI=1S/C21H17FN2O7/c1-12(20(25)23-16-11-13(24(27)28)7-8-18(16)29-2)30-21(26)19-10-9-17(31-19)14-5-3-4-6-15(14)22/h3-12H,1-2H3,(H,23,25)