1-(3-nitrophenyl)sulfonyl-5-(4-nitrophenyl)sulfonyl-1,3,5,7-tetrazocane

Systemtic Name: 1-(3-nitrophenyl)sulfonyl-5-(4-nitrophenyl)sulfonyl-1,3,5,7-tetrazocane Openeye Name: 1-(3-nitrophenyl)sulfonyl-5-(4-nitrophenyl)sulfonyl-1,3,5,7-tetrazocane CAS Name: 1-(3-nitrophenyl)sulfonyl-5-(4-nitrophenyl)sulfonyl-1,3,5,7-tetrazocane IUPAC Name: 1-(3-nitrophenyl)sulfonyl-5-(4-nitrophenyl)sulfonyl-1,3,5,7-tetrazocane Traditional Name: 1-(3-nitrophenyl)sulfonyl-5-nosyl-1,3,5,7-tetrazocane Formula: C16H18N6O8S2 MolecularWeight: 486.47952

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Descriptors Computed from Structure

Canonical SMILES:

C1NCN(CNCN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1NCN(CNCN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O8S2/c23-21(24)13-4-6-15(7-5-13)31(27,28)19-9-17-11-20(12-18-10-19)32(29,30)16-3-1-2-14(8-16)22(25)26/h1-8,17-18H,9-12H2