3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid

Systemtic Name: 3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid Openeye Name: 3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid CAS Name: 3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid IUPAC Name: 3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid Traditional Name: 3,7-dinitrodibenzothiophene-2,8-dicarboxylic acid Formula: C14H6N2O8S MolecularWeight: 362.27104

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C3=CC(=C(C=C3SC2=CC(=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=C2C3=CC(=C(C=C3SC2=CC(=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H6N2O8S/c17-13(18)7-1-5-6-2-8(14(19)20)10(16(23)24)4-12(6)25-11(5)3-9(7)15(21)22/h1-4H,(H,17,18)(H,19,20)