5-methyl-1,6-bis(oxidanyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 5-methyl-1,6-bis(oxidanyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: 1,6-dihydroxy-5-methyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: 1,6-dihydroxy-5-methyl-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 1,6-dihydroxy-5-methylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 1,6-dihydroxy-5-methyl-cyclohexa-2,4-diene-1-carboxylate Formula: C8H9O4- MolecularWeight: 169.15466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1O)(C(=O)[O-])O

Isomeric SMILES

CC1=CC=CC(C1O)(C(=O)[O-])O

InChI

InChI=1S/C8H10O4/c1-5-3-2-4-8(12,6(5)9)7(10)11/h2-4,6,9,12H,1H3,(H,10,11)/p-1