propan-2-yl 4-bromanyl-3-oxidanyl-butanoate

Systemtic Name: propan-2-yl 4-bromanyl-3-oxidanyl-butanoate Openeye Name: isopropyl 4-bromo-3-hydroxy-butanoate CAS Name: 4-bromo-3-hydroxybutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-bromo-3-hydroxybutanoate Traditional Name: 4-bromo-3-hydroxy-butyric acid isopropyl ester Formula: C7H13BrO3 MolecularWeight: 225.08032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13BrO3/c1-5(2)11-7(10)3-6(9)4-8/h5-6,9H,3-4H2,1-2H3