3-(1,3-benzodioxol-5-ylmethyl)-5-(2,6-dimethoxypyrimidin-4-yl)-1,2,4-oxadiazole

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-(2,6-dimethoxypyrimidin-4-yl)-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-(2,6-dimethoxypyrimidin-4-yl)-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-(2,6-dimethoxy-4-pyrimidinyl)-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-(2,6-dimethoxypyrimidin-4-yl)-1,2,4-oxadiazole Traditional Name: 5-(2,6-dimethoxypyrimidin-4-yl)-3-piperonyl-1,2,4-oxadiazole Formula: C16H14N4O5 MolecularWeight: 342.30616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C2=NC(=NO2)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=NC(=NC(=C1)C2=NC(=NO2)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C16H14N4O5/c1-21-14-7-10(17-16(19-14)22-2)15-18-13(20-25-15)6-9-3-4-11-12(5-9)24-8-23-11/h3-5,7H,6,8H2,1-2H3