disodium 3-[2-(2-hydroxyethyloxy)-2-oxidanylidene-ethyl]-6-methyl-cyclohex-4-ene-1,2-dicarboxylate

Systemtic Name: disodium 3-[2-(2-hydroxyethyloxy)-2-oxidanylidene-ethyl]-6-methyl-cyclohex-4-ene-1,2-dicarboxylate Openeye Name: disodium 3-[2-(2-hydroxyethoxy)-2-oxo-ethyl]-6-methyl-cyclohex-4-ene-1,2-dicarboxylate CAS Name: disodium 3-[2-(2-hydroxyethoxy)-2-oxoethyl]-6-methylcyclohex-4-ene-1,2-dicarboxylate IUPAC Name: disodium 3-[2-(2-hydroxyethoxy)-2-oxoethyl]-6-methylcyclohex-4-ene-1,2-dicarboxylate Traditional Name: disodium 3-[2-(2-hydroxyethoxy)-2-keto-ethyl]-6-methyl-cyclohex-4-ene-1,2-dicarboxylate Formula: C13H16Na2O7 MolecularWeight: 330.24148

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C(C1C(=O)[O-])C(=O)[O-])CC(=O)OCCO.[Na+].[Na+]

Isomeric SMILES

CC1C=CC(C(C1C(=O)[O-])C(=O)[O-])CC(=O)OCCO.[Na+].[Na+]

InChI

InChI=1S/C13H18O7.2Na/c1-7-2-3-8(6-9(15)20-5-4-14)11(13(18)19)10(7)12(16)17;;/h2-3,7-8,10-11,14H,4-6H2,1H3,(H,16,17)(H,18,19);;/q;2*+1/p-2