(2S,4R,5S)-2-ethoxy-4-nitro-5-phenyl-cyclohexan-1-one

Systemtic Name: (2S,4R,5S)-2-ethoxy-4-nitro-5-phenyl-cyclohexan-1-one Openeye Name: (2S,4R,5S)-2-ethoxy-4-nitro-5-phenyl-cyclohexanone CAS Name: (2S,4R,5S)-2-ethoxy-4-nitro-5-phenyl-1-cyclohexanone IUPAC Name: (2S,4R,5S)-2-ethoxy-4-nitro-5-phenylcyclohexan-1-one Traditional Name: (2S,4R,5S)-2-ethoxy-4-nitro-5-phenyl-cyclohexanone Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(C(CC1=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCO[C@H]1C[C@H]([C@@H](CC1=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17NO4/c1-2-19-14-9-12(15(17)18)11(8-13(14)16)10-6-4-3-5-7-10/h3-7,11-12,14H,2,8-9H2,1H3/t11-,12+,14-/m0/s1