[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid [5-(2-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C13H9N3O5 MolecularWeight: 287.22766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NN=C(O2)COC(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=COC(=C1)C2=NN=C(O2)COC(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C13H9N3O5/c17-13(9-3-5-16(18)6-4-9)20-8-11-14-15-12(21-11)10-2-1-7-19-10/h1-7H,8H2