1,2,3-trinitrodibenzothiophene 5,5-dioxide

Systemtic Name: 1,2,3-trinitrodibenzothiophene 5,5-dioxide Openeye Name: 1,2,3-trinitrodibenzothiophene 5,5-dioxide CAS Name: 1,2,3-trinitrodibenzothiophene 5,5-dioxide IUPAC Name: 1,2,3-trinitrodibenzothiophene 5,5-dioxide Traditional Name: 1,2,3-trinitrodibenzothiophene 5,5-dioxide Formula: C12H5N3O8S MolecularWeight: 351.2484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2(=O)=O)C=C(C(=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2(=O)=O)C=C(C(=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H5N3O8S/c16-13(17)7-5-9-10(12(15(20)21)11(7)14(18)19)6-3-1-2-4-8(6)24(9,22)23/h1-5H