7-oxabicyclo[2.2.1]hepta-1,3,5-triene; pentanedioic acid

Systemtic Name: 7-oxabicyclo[2.2.1]hepta-1,3,5-triene; pentanedioic acid Openeye Name: glutaric acid; 7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 7-oxabicyclo[2.2.1]hepta-1,3,5-triene; pentanedioic acid IUPAC Name: 7-oxabicyclo[2.2.1]hepta-1,3,5-triene; pentanedioic acid Traditional Name: glutaric acid; 7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C11H12O5 MolecularWeight: 224.20998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC=C1O2.C(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=CC=C1O2.C(CC(=O)O)CC(=O)O

InChI

InChI=1S/C6H4O.C5H8O4/c1-2-6-4-3-5(1)7-6;6-4(7)2-1-3-5(8)9/h1-4H;1-3H2,(H,6,7)(H,8,9)