methyl 5-nitro-2-oxidanylidene-5-(trifluoromethyl)cyclohexane-1-carboxylate

Systemtic Name: methyl 5-nitro-2-oxidanylidene-5-(trifluoromethyl)cyclohexane-1-carboxylate Openeye Name: methyl 5-nitro-2-oxo-5-(trifluoromethyl)cyclohexanecarboxylate CAS Name: 5-nitro-2-oxo-5-(trifluoromethyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-nitro-2-oxo-5-(trifluoromethyl)cyclohexane-1-carboxylate Traditional Name: 2-keto-5-nitro-5-(trifluoromethyl)cyclohexanecarboxylic acid methyl ester Formula: C9H10F3NO5 MolecularWeight: 269.17461

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CCC1=O)(C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CC(CCC1=O)(C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H10F3NO5/c1-18-7(15)5-4-8(13(16)17,9(10,11)12)3-2-6(5)14/h5H,2-4H2,1H3