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

Systemtic Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-bromanyl-5-methoxy-benzoate Openeye Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H12BrFN2O4 MolecularWeight: 407.190583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H12BrFN2O4/c1-23-12-6-7-14(18)13(8-12)17(22)24-9-15-20-16(21-25-15)10-2-4-11(19)5-3-10/h2-8H,9H2,1H3