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(2-nitro-6-oxidanylidene-hexan-3-yl) ethanoate

(2-nitro-6-oxidanylidene-hexan-3-yl) ethanoate

Systemtic Name:(2-nitro-6-oxidanylidene-hexan-3-yl) ethanoate
Openeye Name:[1-(1-nitroethyl)-4-oxo-butyl] acetate
CAS Name:acetic acid (2-nitro-6-oxohexan-3-yl) ester
IUPAC Name:(2-nitro-6-oxohexan-3-yl) acetate
Traditional Name:acetic acid [4-keto-1-(1-nitroethyl)butyl] ester
Formula: C8H13NO5
MolecularWeight: 203.19252
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H13NO5/c1-6(9(12)13)8(4-3-5-10)14-7(2)11/h5-6,8H,3-4H2,1-2H3


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