disodium 7-azanidylsulfonyl-6-nitro-3-oxidanylidene-4H-benzo[h]quinoxalin-2-olate

Systemtic Name: disodium 7-azanidylsulfonyl-6-nitro-3-oxidanylidene-4H-benzo[h]quinoxalin-2-olate Openeye Name: disodium 7-azanidylsulfonyl-6-nitro-3-oxo-4H-benzo[h]quinoxalin-2-olate CAS Name: disodium 7-azanidylsulfonyl-6-nitro-3-oxo-4H-benzo[h]quinoxalin-2-olate IUPAC Name: disodium 7-azanidylsulfonyl-6-nitro-3-oxo-4H-benzo[h]quinoxalin-2-olate Traditional Name: disodium 7-amidylsulfonyl-3-keto-6-nitro-4H-benzo[h]quinoxalin-2-olate Formula: C12H6N4Na2O6S MolecularWeight: 380.24378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)[NH-])[N+](=O)[O-])NC(=O)C(=N3)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)[NH-])[N+](=O)[O-])NC(=O)C(=N3)[O-].[Na+].[Na+]

InChI

InChI=1S/C12H8N4O6S.2Na/c13-23(21,22)8-3-1-2-5-9(8)7(16(19)20)4-6-10(5)15-12(18)11(17)14-6;;/h1-4H,(H4,13,14,15,17,18,21,22);;/q;2*+1/p-2