3-bromanyl-5-tert-butyl-2-methyl-6-oxidanyl-benzoic acid

Systemtic Name: 3-bromanyl-5-tert-butyl-2-methyl-6-oxidanyl-benzoic acid Openeye Name: 5-bromo-3-tert-butyl-2-hydroxy-6-methyl-benzoic acid CAS Name: 5-bromo-3-tert-butyl-2-hydroxy-6-methylbenzoic acid IUPAC Name: 5-bromo-3-tert-butyl-2-hydroxy-6-methylbenzoic acid Traditional Name: 5-bromo-3-tert-butyl-2-hydroxy-6-methyl-benzoic acid Formula: C12H15BrO3 MolecularWeight: 287.1497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C(=O)O)O)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=C(C(=C1C(=O)O)O)C(C)(C)C)Br

InChI

InChI=1S/C12H15BrO3/c1-6-8(13)5-7(12(2,3)4)10(14)9(6)11(15)16/h5,14H,1-4H3,(H,15,16)