3-bromanyl-3-nitro-pentane-2,4-diol

Systemtic Name: 3-bromanyl-3-nitro-pentane-2,4-diol Openeye Name: 3-bromo-3-nitro-pentane-2,4-diol CAS Name: 3-bromo-3-nitropentane-2,4-diol IUPAC Name: 3-bromo-3-nitropentane-2,4-diol Traditional Name: 3-bromo-3-nitro-pentane-2,4-diol Formula: C5H10BrNO4 MolecularWeight: 228.0412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C)O)([N+](=O)[O-])Br)O

Isomeric SMILES

CC(C(C(C)O)([N+](=O)[O-])Br)O

InChI

InChI=1S/C5H10BrNO4/c1-3(8)5(6,4(2)9)7(10)11/h3-4,8-9H,1-2H3