1-(2-methyl-5-nitro-2-oxidanyl-5-propyl-cyclohexyl)ethanone

Systemtic Name: 1-(2-methyl-5-nitro-2-oxidanyl-5-propyl-cyclohexyl)ethanone Openeye Name: 1-(2-hydroxy-2-methyl-5-nitro-5-propyl-cyclohexyl)ethanone CAS Name: 1-(2-hydroxy-2-methyl-5-nitro-5-propylcyclohexyl)ethanone IUPAC Name: 1-(2-hydroxy-2-methyl-5-nitro-5-propylcyclohexyl)ethanone Traditional Name: 1-(2-hydroxy-2-methyl-5-nitro-5-propyl-cyclohexyl)ethanone Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(C(C1)C(=O)C)(C)O)[N+](=O)[O-]

Isomeric SMILES

CCCC1(CCC(C(C1)C(=O)C)(C)O)[N+](=O)[O-]

InChI

InChI=1S/C12H21NO4/c1-4-5-12(13(16)17)7-6-11(3,15)10(8-12)9(2)14/h10,15H,4-8H2,1-3H3