methyl 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-benzoate CAS Name: 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitrobenzoate Traditional Name: 4-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-benzoic acid methyl ester Formula: C17H12FN3O6 MolecularWeight: 373.292083

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H12FN3O6/c1-25-17(22)11-4-7-14(13(8-11)21(23)24)26-9-15-19-16(20-27-15)10-2-5-12(18)6-3-10/h2-8H,9H2,1H3