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

Systemtic Name: methyl 3-tert-butyl-4-oxidanyl-benzoate Openeye Name: methyl 3-tert-butyl-4-hydroxy-benzoate CAS Name: 3-tert-butyl-4-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-tert-butyl-4-hydroxybenzoate Traditional Name: 3-tert-butyl-4-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=CC(=C1)C(=O)OC)O

Isomeric SMILES

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

InChI

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