2,4-diethyl-5-oxidanyl-benzene-1,3-dicarboxylate

Systemtic Name: 2,4-diethyl-5-oxidanyl-benzene-1,3-dicarboxylate Openeye Name: 2,4-diethyl-5-hydroxy-benzene-1,3-dicarboxylate CAS Name: 2,4-diethyl-5-hydroxybenzene-1,3-dicarboxylate IUPAC Name: 2,4-diethyl-5-hydroxybenzene-1,3-dicarboxylate Traditional Name: 2,4-diethyl-5-hydroxy-isophthalate Formula: C12H12O5-2 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1C(=O)[O-])O)CC)C(=O)[O-]

Isomeric SMILES

CCC1=C(C(=C(C=C1C(=O)[O-])O)CC)C(=O)[O-]

InChI

InChI=1S/C12H14O5/c1-3-6-8(11(14)15)5-9(13)7(4-2)10(6)12(16)17/h5,13H,3-4H2,1-2H3,(H,14,15)(H,16,17)/p-2