1-(4-bromanyl-5-methyl-5-oxidanyl-2-oxidanylidene-furan-3-yl)butyl nitrate

Systemtic Name: 1-(4-bromanyl-5-methyl-5-oxidanyl-2-oxidanylidene-furan-3-yl)butyl nitrate Openeye Name: 1-(4-bromo-5-hydroxy-5-methyl-2-oxo-3-furyl)butyl nitrate CAS Name: nitric acid 1-(4-bromo-5-hydroxy-5-methyl-2-oxo-3-furanyl)butyl ester IUPAC Name: 1-(4-bromo-5-hydroxy-5-methyl-2-oxofuran-3-yl)butyl nitrate Traditional Name: nitric acid 1-(4-bromo-5-hydroxy-2-keto-5-methyl-3-furyl)butyl ester Formula: C9H12BrNO6 MolecularWeight: 310.09868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C(OC1=O)(C)O)Br)O[N+](=O)[O-]

Isomeric SMILES

CCCC(C1=C(C(OC1=O)(C)O)Br)O[N+](=O)[O-]

InChI

InChI=1S/C9H12BrNO6/c1-3-4-5(17-11(14)15)6-7(10)9(2,13)16-8(6)12/h5,13H,3-4H2,1-2H3