3-methyl-1,5,6-tris(oxidanyl)cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 3-methyl-1,5,6-tris(oxidanyl)cyclohex-3-ene-1-carboxylic acid Openeye Name: 1,5,6-trihydroxy-3-methyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 1,5,6-trihydroxy-3-methyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 1,5,6-trihydroxy-3-methylcyclohex-3-ene-1-carboxylic acid Traditional Name: 1,5,6-trihydroxy-3-methyl-cyclohex-3-ene-1-carboxylic acid Formula: C8H12O5 MolecularWeight: 188.17788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(C1)(C(=O)O)O)O)O

Isomeric SMILES

CC1=CC(C(C(C1)(C(=O)O)O)O)O

InChI

InChI=1S/C8H12O5/c1-4-2-5(9)6(10)8(13,3-4)7(11)12/h2,5-6,9-10,13H,3H2,1H3,(H,11,12)