sodium (3E)-6-methyl-3-[4-methyl-2,3,5-tris(oxidanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-5-oxidanyl-cyclohex-5-ene-1,2,4-trione

Systemtic Name: sodium (3E)-6-methyl-3-[4-methyl-2,3,5-tris(oxidanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-5-oxidanyl-cyclohex-5-ene-1,2,4-trione Openeye Name: sodium (3E)-5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)cyclohex-5-ene-1,2,4-trione CAS Name: sodium (3E)-5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)cyclohex-5-ene-1,2,4-trione IUPAC Name: sodium (3E)-5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)cyclohex-5-ene-1,2,4-trione Traditional Name: sodium (3E)-5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-6-keto-4-methyl-cyclohexa-2,4-dien-1-ylidene)cyclohex-5-ene-1,2,4-trione Formula: C14H10NaO8+ MolecularWeight: 329.21417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C2C(=O)C(=C(C(=O)C2=O)C)O)C(=C1O)O)O.[Na+]

Isomeric SMILES

CC1=C(C(=O)/C(=C/2\C(=O)C(=C(C(=O)C2=O)C)O)/C(=C1O)O)O.[Na+]

InChI

InChI=1S/C14H10O8.Na/c1-3-7(15)11(19)5(12(20)8(3)16)6-13(21)9(17)4(2)10(18)14(6)22;/h15-17,19H,1-2H3;/q;+1/b6-5+;