2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]benzoic acid

Systemtic Name: 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]benzoic acid Openeye Name: 2-[3-(tetrahydrofuran-2-ylmethyl)-1,2,4-oxadiazol-5-yl]benzoic acid CAS Name: 2-[3-(2-oxolanylmethyl)-1,2,4-oxadiazol-5-yl]benzoic acid IUPAC Name: 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]benzoic acid Traditional Name: 2-[3-(tetrahydrofurfuryl)-1,2,4-oxadiazol-5-yl]benzoic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CC2=NOC(=N2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CC(OC1)CC2=NOC(=N2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C14H14N2O4/c17-14(18)11-6-2-1-5-10(11)13-15-12(16-20-13)8-9-4-3-7-19-9/h1-2,5-6,9H,3-4,7-8H2,(H,17,18)