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1-nitrooctan-2-yl ethanoate

1-nitrooctan-2-yl ethanoate

Systemtic Name:1-nitrooctan-2-yl ethanoate
Openeye Name:1-(nitromethyl)heptyl acetate
CAS Name:acetic acid 1-nitrooctan-2-yl ester
IUPAC Name:1-nitrooctan-2-yl acetate
Traditional Name:acetic acid 1-(nitromethyl)heptyl ester
Formula: C10H19NO4
MolecularWeight: 217.26216
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C[N+](=O)[O-])OC(=O)C


Isomeric SMILES

CCCCCCC(C[N+](=O)[O-])OC(=O)C


InChI

InChI=1S/C10H19NO4/c1-3-4-5-6-7-10(8-11(13)14)15-9(2)12/h10H,3-8H2,1-2H3


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