1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane

Systemtic Name: 1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane Openeye Name: 1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane CAS Name: 1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane IUPAC Name: 1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane Traditional Name: 1-nitro-3,7-bis[(3-nitrophenyl)sulfonyl]-5-nitroso-1,3,5,7-tetrazocane Formula: C16H16N8O11S2 MolecularWeight: 560.47524

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CN(CN(CN1S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N=O

Isomeric SMILES

C1N(CN(CN(CN1S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N=O

InChI

InChI=1S/C16H16N8O11S2/c25-17-18-9-20(36(32,33)15-5-1-3-13(7-15)22(26)27)11-19(24(30)31)12-21(10-18)37(34,35)16-6-2-4-14(8-16)23(28)29/h1-8H,9-12H2