(2Z,7E)-2,7-bis(diazanylidene)-9-nitro-4,4-bis(oxidanylidene)-5,6-dihydro-1,4$l^{6}-benzoxathionine-5-carbohydrazide

Systemtic Name: (2Z,7E)-2,7-bis(diazanylidene)-9-nitro-4,4-bis(oxidanylidene)-5,6-dihydro-1,4$l^{6}-benzoxathionine-5-carbohydrazide Openeye Name: (2Z,7E)-2,7-dihydrazinylidene-9-nitro-4,4-dioxo-5,6-dihydro-1,4$l^{6}-benzoxathionine-5-carbohydrazide CAS Name: (2Z,7E)-2,7-dihydrazinylidene-9-nitro-4,4-dioxo-5,6-dihydro-1,4$l^{6}-benzoxathionin-5-carbohydrazide IUPAC Name: (2Z,7E)-2,7-dihydrazinylidene-9-nitro-4,4-dioxo-5,6-dihydro-1,4$l^{6}-benzoxathionine-5-carbohydrazide Traditional Name: (2Z,7E)-2,7-dihydrazono-4,4-diketo-9-nitro-5,6-dihydro-1,4$l^{6}-benzoxathionin-5-carbohydrazide Formula: C12H15N7O6S MolecularWeight: 385.3558

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S(=O)(=O)CC(=NN)OC2=C(C1=NN)C=C(C=C2)[N+](=O)[O-])C(=O)NN

Isomeric SMILES

C\1C(S(=O)(=O)C/C(=N/N)/OC2=C(/C1=N/N)C=C(C=C2)[N+](=O)[O-])C(=O)NN

InChI

InChI=1S/C12H15N7O6S/c13-16-8-4-10(12(20)18-15)26(23,24)5-11(17-14)25-9-2-1-6(19(21)22)3-7(8)9/h1-3,10H,4-5,13-15H2,(H,18,20)/b16-8+,17-11-