sodium 6-methoxycarbonyl-1,2,6-trimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: sodium 6-methoxycarbonyl-1,2,6-trimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: sodium 6-methoxycarbonyl-1,2,6-trimethyl-cyclohex-3-ene-1-carboxylate CAS Name: sodium 6-methoxycarbonyl-1,2,6-trimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: sodium 6-methoxycarbonyl-1,2,6-trimethylcyclohex-3-ene-1-carboxylate Traditional Name: sodium 6-carbomethoxy-1,2,6-trimethyl-cyclohex-3-ene-1-carboxylate Formula: C12H17NaO4 MolecularWeight: 248.25075

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC(C1(C)C(=O)[O-])(C)C(=O)OC.[Na+]

Isomeric SMILES

CC1C=CCC(C1(C)C(=O)[O-])(C)C(=O)OC.[Na+]

InChI

InChI=1S/C12H18O4.Na/c1-8-6-5-7-11(2,10(15)16-4)12(8,3)9(13)14;/h5-6,8H,7H2,1-4H3,(H,13,14);/q;+1/p-1