(2,4-dinitrophenyl)-[(1R,2S,5R)-5-methyl-1-nitro-2-propan-2-yl-cyclohexyl]diazene

Systemtic Name: (2,4-dinitrophenyl)-[(1R,2S,5R)-5-methyl-1-nitro-2-propan-2-yl-cyclohexyl]diazene Openeye Name: (2,4-dinitrophenyl)-[(1R,2S,5R)-2-isopropyl-5-methyl-1-nitro-cyclohexyl]diazene CAS Name: (2,4-dinitrophenyl)-[(1R,2S,5R)-5-methyl-1-nitro-2-propan-2-ylcyclohexyl]diazene IUPAC Name: (2,4-dinitrophenyl)-[(1R,2S,5R)-5-methyl-1-nitro-2-propan-2-ylcyclohexyl]diazene Traditional Name: (2,4-dinitrophenyl)-[(1R,2S,5R)-2-isopropyl-5-methyl-1-nitro-cyclohexyl]diazene Formula: C16H21N5O6 MolecularWeight: 379.36784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)(N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@](C1)(N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(C)C

InChI

InChI=1S/C16H21N5O6/c1-10(2)13-6-4-11(3)9-16(13,21(26)27)18-17-14-7-5-12(19(22)23)8-15(14)20(24)25/h5,7-8,10-11,13H,4,6,9H2,1-3H3/t11-,13+,16-/m1/s1