methyl 3-nitro-2-(2-oxidanylidenecyclohexyl)propanoate

Systemtic Name: methyl 3-nitro-2-(2-oxidanylidenecyclohexyl)propanoate Openeye Name: methyl 3-nitro-2-(2-oxocyclohexyl)propanoate CAS Name: 3-nitro-2-(2-oxocyclohexyl)propanoic acid methyl ester IUPAC Name: methyl 3-nitro-2-(2-oxocyclohexyl)propanoate Traditional Name: 2-(2-ketocyclohexyl)-3-nitro-propionic acid methyl ester Formula: C10H15NO5 MolecularWeight: 229.2298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C[N+](=O)[O-])C1CCCCC1=O

Isomeric SMILES

COC(=O)C(C[N+](=O)[O-])C1CCCCC1=O

InChI

InChI=1S/C10H15NO5/c1-16-10(13)8(6-11(14)15)7-4-2-3-5-9(7)12/h7-8H,2-6H2,1H3