[(1R,4R,5S)-4,5-diacetyloxy-2-nitro-1-oxidanyl-cyclopent-2-en-1-yl]methyl ethanoate

Systemtic Name: [(1R,4R,5S)-4,5-diacetyloxy-2-nitro-1-oxidanyl-cyclopent-2-en-1-yl]methyl ethanoate Openeye Name: [(1R,4R,5S)-4,5-diacetoxy-1-hydroxy-2-nitro-cyclopent-2-en-1-yl]methyl acetate CAS Name: acetic acid [(1R,4R,5S)-4,5-diacetyloxy-1-hydroxy-2-nitro-1-cyclopent-2-enyl]methyl ester IUPAC Name: [(1R,4R,5S)-4,5-diacetyloxy-1-hydroxy-2-nitrocyclopent-2-en-1-yl]methyl acetate Traditional Name: acetic acid [(1R,4R,5S)-4,5-diacetoxy-1-hydroxy-2-nitro-cyclopent-2-en-1-yl]methyl ester Formula: C12H15NO9 MolecularWeight: 317.2488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(C(C=C1[N+](=O)[O-])OC(=O)C)OC(=O)C)O

Isomeric SMILES

CC(=O)OC[C@]1([C@H]([C@@H](C=C1[N+](=O)[O-])OC(=O)C)OC(=O)C)O

InChI

InChI=1S/C12H15NO9/c1-6(14)20-5-12(17)10(13(18)19)4-9(21-7(2)15)11(12)22-8(3)16/h4,9,11,17H,5H2,1-3H3/t9-,11+,12+/m1/s1