(2S)-2-bromanyl-5-methoxy-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-bromanyl-5-methoxy-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-bromo-5-methoxy-5-oxo-pentanoic acid CAS Name: (2S)-2-bromo-5-methoxy-5-oxopentanoic acid IUPAC Name: (2S)-2-bromo-5-methoxy-5-oxopentanoic acid Traditional Name: (2S)-2-bromo-5-keto-5-methoxy-valeric acid Formula: C6H9BrO4 MolecularWeight: 225.03726

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)O)Br

Isomeric SMILES

COC(=O)CC[C@@H](C(=O)O)Br

InChI

InChI=1S/C6H9BrO4/c1-11-5(8)3-2-4(7)6(9)10/h4H,2-3H2,1H3,(H,9,10)/t4-/m0/s1