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

Systemtic Name: 2-[3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid Openeye Name: 2-[3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid CAS Name: 2-[3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid IUPAC Name: 2-[3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid Traditional Name: 2-[3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid Formula: C18H16N2O6 MolecularWeight: 356.32944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)O)OC)OC

InChI

InChI=1S/C18H16N2O6/c1-23-13-9-8-12(14(24-2)15(13)25-3)16-19-17(26-20-16)10-6-4-5-7-11(10)18(21)22/h4-9H,1-3H3,(H,21,22)