(2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenyl-ethyl]cyclohexan-1-one

Systemtic Name: (2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenyl-ethyl]cyclohexan-1-one Openeye Name: (2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenyl-ethyl]cyclohexanone CAS Name: (2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenylethyl]-1-cyclohexanone IUPAC Name: (2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenylethyl]cyclohexan-1-one Traditional Name: (2S,4S)-4-tert-butyl-2-[(1R)-2-nitro-1-phenyl-ethyl]cyclohexanone Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=O)[C@@H](C1)[C@@H](C[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C18H25NO3/c1-18(2,3)14-9-10-17(20)15(11-14)16(12-19(21)22)13-7-5-4-6-8-13/h4-8,14-16H,9-12H2,1-3H3/t14-,15-,16-/m0/s1