1,3-benzodioxol-5-yl 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: 1,3-benzodioxol-5-yl 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propionic acid 1,3-benzodioxol-5-yl ester Formula: C18H13FN2O5 MolecularWeight: 356.304623

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H13FN2O5/c19-12-3-1-11(2-4-12)18-20-16(26-21-18)7-8-17(22)25-13-5-6-14-15(9-13)24-10-23-14/h1-6,9H,7-8,10H2