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

Systemtic Name: 3-[5-(1,3-benzodioxol-5-yloxymethyl)-1,3,4-oxadiazol-2-yl]propanoate Openeye Name: 3-[5-(1,3-benzodioxol-5-yloxymethyl)-1,3,4-oxadiazol-2-yl]propanoate CAS Name: 3-[5-(1,3-benzodioxol-5-yloxymethyl)-1,3,4-oxadiazol-2-yl]propanoate IUPAC Name: 3-[5-(1,3-benzodioxol-5-yloxymethyl)-1,3,4-oxadiazol-2-yl]propanoate Traditional Name: 3-[5-(1,3-benzodioxol-5-yloxymethyl)-1,3,4-oxadiazol-2-yl]propionate Formula: C13H11N2O6- MolecularWeight: 291.23624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=NN=C(O3)CCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=NN=C(O3)CCC(=O)[O-]

InChI

InChI=1S/C13H12N2O6/c16-13(17)4-3-11-14-15-12(21-11)6-18-8-1-2-9-10(5-8)20-7-19-9/h1-2,5H,3-4,6-7H2,(H,16,17)/p-1