(2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]cyclohexan-1-one

Systemtic Name: (2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]cyclohexan-1-one Openeye Name: (2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]cyclohexanone CAS Name: (2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]-1-cyclohexanone IUPAC Name: (2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]cyclohexan-1-one Traditional Name: (2S,4S)-4-methyl-2-[(1R)-2-nitro-1-(4-phenylphenyl)ethyl]cyclohexanone Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C(C1)C(C[N+](=O)[O-])C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC(=O)[C@@H](C1)[C@@H](C[N+](=O)[O-])C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c1-15-7-12-21(23)19(13-15)20(14-22(24)25)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h2-6,8-11,15,19-20H,7,12-14H2,1H3/t15-,19-,20-/m0/s1