6-bromanyl-2-tert-butyl-5-oxidanyl-3-oxidanylidene-hexanoic acid

Systemtic Name: 6-bromanyl-2-tert-butyl-5-oxidanyl-3-oxidanylidene-hexanoic acid Openeye Name: 6-bromo-2-tert-butyl-5-hydroxy-3-oxo-hexanoic acid CAS Name: 6-bromo-2-tert-butyl-5-hydroxy-3-oxohexanoic acid IUPAC Name: 6-bromo-2-tert-butyl-5-hydroxy-3-oxohexanoic acid Traditional Name: 6-bromo-2-tert-butyl-5-hydroxy-3-keto-hexanoic acid Formula: C10H17BrO4 MolecularWeight: 281.14358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)CC(CBr)O)C(=O)O

Isomeric SMILES

CC(C)(C)C(C(=O)CC(CBr)O)C(=O)O

InChI

InChI=1S/C10H17BrO4/c1-10(2,3)8(9(14)15)7(13)4-6(12)5-11/h6,8,12H,4-5H2,1-3H3,(H,14,15)