(2S)-2-[(1R)-1-(5-chloranyl-2-nitro-phenyl)-2-nitro-ethyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(1R)-1-(5-chloranyl-2-nitro-phenyl)-2-nitro-ethyl]cyclohexan-1-one Openeye Name: (2S)-2-[(1R)-1-(5-chloro-2-nitro-phenyl)-2-nitro-ethyl]cyclohexanone CAS Name: (2S)-2-[(1R)-1-(5-chloro-2-nitrophenyl)-2-nitroethyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(1R)-1-(5-chloro-2-nitrophenyl)-2-nitroethyl]cyclohexan-1-one Traditional Name: (2S)-2-[(1R)-1-(5-chloro-2-nitro-phenyl)-2-nitro-ethyl]cyclohexanone Formula: C14H15ClN2O5 MolecularWeight: 326.7323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)C(C[N+](=O)[O-])C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=O)[C@@H](C1)[C@@H](C[N+](=O)[O-])C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H15ClN2O5/c15-9-5-6-13(17(21)22)11(7-9)12(8-16(19)20)10-3-1-2-4-14(10)18/h5-7,10,12H,1-4,8H2/t10-,12+/m0/s1