sodium 3-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoate

Systemtic Name: sodium 3-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoate Openeye Name: sodium 3-(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)propanoate CAS Name: sodium 3-(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)propanoate IUPAC Name: sodium 3-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoate Traditional Name: sodium 3-(3,6-diketo-4,5-dimethoxy-2-methyl-cyclohexa-1,4-dien-1-yl)propionate Formula: C12H13NaO6 MolecularWeight: 276.21779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)OC)OC)CCC(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)OC)OC)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C12H14O6.Na/c1-6-7(4-5-8(13)14)10(16)12(18-3)11(17-2)9(6)15;/h4-5H2,1-3H3,(H,13,14);/q;+1/p-1