3,5-dicarboxy-1,3,5-trimethyl-cyclohexane-1-carboxylate

Systemtic Name: 3,5-dicarboxy-1,3,5-trimethyl-cyclohexane-1-carboxylate Openeye Name: 3,5-dicarboxy-1,3,5-trimethyl-cyclohexanecarboxylate CAS Name: 3,5-dicarboxy-1,3,5-trimethyl-1-cyclohexanecarboxylate IUPAC Name: 3,5-dicarboxy-1,3,5-trimethylcyclohexane-1-carboxylate Traditional Name: 3,5-dicarboxy-1,3,5-trimethyl-cyclohexanecarboxylate Formula: C12H17O6- MolecularWeight: 257.25978

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C(=O)[O-])(C)C(=O)O)C(=O)O

Isomeric SMILES

CC1(CC(CC(C1)(C)C(=O)[O-])(C)C(=O)O)C(=O)O

InChI

InChI=1S/C12H18O6/c1-10(7(13)14)4-11(2,8(15)16)6-12(3,5-10)9(17)18/h4-6H2,1-3H3,(H,13,14)(H,15,16)(H,17,18)/p-1