1-(5-chloranyl-3-nitro-2-oxidanyl-cyclohexyl)ethanone

Systemtic Name: 1-(5-chloranyl-3-nitro-2-oxidanyl-cyclohexyl)ethanone Openeye Name: 1-(5-chloro-2-hydroxy-3-nitro-cyclohexyl)ethanone CAS Name: 1-(5-chloro-2-hydroxy-3-nitrocyclohexyl)ethanone IUPAC Name: 1-(5-chloro-2-hydroxy-3-nitrocyclohexyl)ethanone Traditional Name: 1-(5-chloro-2-hydroxy-3-nitro-cyclohexyl)ethanone Formula: C8H12ClNO4 MolecularWeight: 221.63818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(CC(C1O)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)C1CC(CC(C1O)[N+](=O)[O-])Cl

InChI

InChI=1S/C8H12ClNO4/c1-4(11)6-2-5(9)3-7(8(6)12)10(13)14/h5-8,12H,2-3H2,1H3