3-tert-butyl-5-methoxy-2-oxidanyl-benzoate

Systemtic Name: 3-tert-butyl-5-methoxy-2-oxidanyl-benzoate Openeye Name: 3-tert-butyl-2-hydroxy-5-methoxy-benzoate CAS Name: 3-tert-butyl-2-hydroxy-5-methoxybenzoate IUPAC Name: 3-tert-butyl-2-hydroxy-5-methoxybenzoate Traditional Name: 3-tert-butyl-2-hydroxy-5-methoxy-benzoate Formula: C12H15O4- MolecularWeight: 223.2451

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)OC)C(=O)[O-])O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)OC)C(=O)[O-])O

InChI

InChI=1S/C12H16O4/c1-12(2,3)9-6-7(16-4)5-8(10(9)13)11(14)15/h5-6,13H,1-4H3,(H,14,15)/p-1