1,5-dinitro-4,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate

Systemtic Name: 1,5-dinitro-4,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate Openeye Name: 4,8-dihydroxy-1,5-dinitro-9,10-dioxo-anthracene-2-sulfonate CAS Name: 4,8-dihydroxy-1,5-dinitro-9,10-dioxo-2-anthracenesulfonate IUPAC Name: 4,8-dihydroxy-1,5-dinitro-9,10-dioxoanthracene-2-sulfonate Traditional Name: 4,8-dihydroxy-9,10-diketo-1,5-dinitro-anthracene-2-sulfonate Formula: C14H5N2O11S- MolecularWeight: 409.2613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3O)S(=O)(=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3O)S(=O)(=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C14H6N2O11S/c17-5-2-1-4(15(21)22)8-9(5)14(20)11-10(13(8)19)6(18)3-7(28(25,26)27)12(11)16(23)24/h1-3,17-18H,(H,25,26,27)/p-1