(2R,3S,4R)-4-methyl-3-nitro-2-(4-nitrophenyl)-4-oxidanyl-cyclohexane-1,1-dicarbonitrile

Systemtic Name: (2R,3S,4R)-4-methyl-3-nitro-2-(4-nitrophenyl)-4-oxidanyl-cyclohexane-1,1-dicarbonitrile Openeye Name: (2R,3S,4R)-4-hydroxy-4-methyl-3-nitro-2-(4-nitrophenyl)cyclohexane-1,1-dicarbonitrile CAS Name: (2R,3S,4R)-4-hydroxy-4-methyl-3-nitro-2-(4-nitrophenyl)cyclohexane-1,1-dicarbonitrile IUPAC Name: (2R,3S,4R)-4-hydroxy-4-methyl-3-nitro-2-(4-nitrophenyl)cyclohexane-1,1-dicarbonitrile Traditional Name: (2R,3S,4R)-4-hydroxy-4-methyl-3-nitro-2-(4-nitrophenyl)cyclohexane-1,1-dicarbonitrile Formula: C15H14N4O5 MolecularWeight: 330.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C(C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-])(C#N)C#N)O

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O5/c1-14(20)6-7-15(8-16,9-17)12(13(14)19(23)24)10-2-4-11(5-3-10)18(21)22/h2-5,12-13,20H,6-7H2,1H3/t12-,13-,14+/m0/s1