3,7-dinitrodibenzothiophene 5,5-dioxide

Systemtic Name: 3,7-dinitrodibenzothiophene 5,5-dioxide Openeye Name: 3,7-dinitrodibenzothiophene 5,5-dioxide CAS Name: 3,7-dinitrodibenzothiophene 5,5-dioxide IUPAC Name: 3,7-dinitrodibenzothiophene 5,5-dioxide Traditional Name: 3,7-dinitrodibenzothiophene 5,5-dioxide Formula: C12H6N2O6S MolecularWeight: 306.25084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H6N2O6S/c15-13(16)7-1-3-9-10-4-2-8(14(17)18)6-12(10)21(19,20)11(9)5-7/h1-6H