[(2S,3S,6S)-3-tert-butylperoxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl ethanoate

Systemtic Name: [(2S,3S,6S)-3-tert-butylperoxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl ethanoate Openeye Name: [(2S,3S,6S)-3-tert-butylperoxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl acetate CAS Name: acetic acid [(2S,3S,6S)-3-tert-butyldioxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl ester IUPAC Name: [(2S,3S,6S)-3-tert-butylperoxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl acetate Traditional Name: acetic acid [(2S,3S,6S)-3-tert-butylperoxy-2-methoxy-4-nitro-3,6-dihydro-2H-pyran-6-yl]methyl ester Formula: C13H21NO8 MolecularWeight: 319.30774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C=C(C(C(O1)OC)OOC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC[C@@H]1C=C([C@@H]([C@H](O1)OC)OOC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H21NO8/c1-8(15)19-7-9-6-10(14(16)17)11(12(18-5)20-9)21-22-13(2,3)4/h6,9,11-12H,7H2,1-5H3/t9-,11-,12-/m0/s1