methyl 4-tert-butyl-3-oxidanyl-benzoate

Systemtic Name: methyl 4-tert-butyl-3-oxidanyl-benzoate Openeye Name: methyl 4-tert-butyl-3-hydroxy-benzoate CAS Name: 4-tert-butyl-3-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-tert-butyl-3-hydroxybenzoate Traditional Name: 4-tert-butyl-3-hydroxy-benzoic acid methyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)OC)O

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)OC)O

InChI

InChI=1S/C12H16O3/c1-12(2,3)9-6-5-8(7-10(9)13)11(14)15-4/h5-7,13H,1-4H3