5-tert-butyl-2-oxidanyl-benzene-1,3-dicarboxylate

Systemtic Name: 5-tert-butyl-2-oxidanyl-benzene-1,3-dicarboxylate Openeye Name: 5-tert-butyl-2-hydroxy-benzene-1,3-dicarboxylate CAS Name: 5-tert-butyl-2-hydroxybenzene-1,3-dicarboxylate IUPAC Name: 5-tert-butyl-2-hydroxybenzene-1,3-dicarboxylate Traditional Name: 5-tert-butyl-2-hydroxy-isophthalate Formula: C12H12O5-2 MolecularWeight: 236.22068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)[O-])O)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)[O-])O)C(=O)[O-]

InChI

InChI=1S/C12H14O5/c1-12(2,3)6-4-7(10(14)15)9(13)8(5-6)11(16)17/h4-5,13H,1-3H3,(H,14,15)(H,16,17)/p-2