sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)-$l^{4}-sulfanylidene]benzenesulfonamide

Systemtic Name: sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)-$l^{4}-sulfanylidene]benzenesulfonamide Openeye Name: sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)-$l^{4}-sulfanylidene]benzenesulfonamide CAS Name: sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)-$l^{4}-sulfanylidene]benzenesulfonamide IUPAC Name: sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)-$l^{4}-sulfanylidene]benzenesulfonamide Traditional Name: sodium (NZ)-N-[nitromethyl-(2-nitrophenyl)sulfuranylidene]benzenesulfonamide Formula: C13H10N3NaO6S2 MolecularWeight: 391.35477

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N=S([CH-][N+](=O)[O-])C2=CC=CC=C2[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/N=S(\[CH-][N+](=O)[O-])/C2=CC=CC=C2[N+](=O)[O-].[Na+]

InChI

InChI=1S/C13H10N3O6S2.Na/c17-15(18)10-23(13-9-5-4-8-12(13)16(19)20)14-24(21,22)11-6-2-1-3-7-11;/h1-10H;/q-1;+1