methyl 2,6-dichloro-3-nitro-benzoate

ChemSpider ID: 26282241
Molecular Formula: C₈H₅Cl₂NO₄
Average mass: 250.035995 Da
Monoisotopic mass: 248.96 Da
Systematic name

methyl 2,6-dichloro-3-nitro-benzoate
SMILES and InChIs

SMILES:

COC(=O)c1c(ccc(c1Cl)[N+](=O)[O-])Cl Copied

Std. InChI:

InChI=1S/C8H5Cl2NO4/c1-15-8(12)6-4(9)2-3-5(7(6)10)11(13)14/h2-3H,1H3 Copied

Std. InChIKey:

HRRKWVIUFQWYMG-UHFFFAOYSA-N Copied
Cite this record
CSID:26282241, http://www.chemspider.com/Chemical-Structure.26282241.html (accessed 12:40, May 25, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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