(2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenyl-cyclohexane-1,1,3,3-tetracarbonitrile

Systemtic Name: (2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenyl-cyclohexane-1,1,3,3-tetracarbonitrile Openeye Name: (2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenyl-cyclohexane-1,1,3,3-tetracarbonitrile CAS Name: (2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenylcyclohexane-1,1,3,3-tetracarbonitrile IUPAC Name: (2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenylcyclohexane-1,1,3,3-tetracarbonitrile Traditional Name: (2S,4S,5S,6S)-4-methyl-5-nitro-2,6-diphenyl-cyclohexane-1,1,3,3-tetracarbonitrile Formula: C23H17N5O2 MolecularWeight: 395.41338

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(C1(C#N)C#N)C2=CC=CC=C2)(C#N)C#N)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H17N5O2/c1-16-20(28(29)30)19(17-8-4-2-5-9-17)23(14-26,15-27)21(22(16,12-24)13-25)18-10-6-3-7-11-18/h2-11,16,19-21H,1H3/t16-,19-,20+,21+/m1/s1