disodium (4-nitroso-3-oxidanyl-7-sulfonatooxy-naphthalen-2-yl) sulfate

Systemtic Name: disodium (4-nitroso-3-oxidanyl-7-sulfonatooxy-naphthalen-2-yl) sulfate Openeye Name: disodium (3-hydroxy-4-nitroso-7-sulfonatooxy-2-naphthyl) sulfate CAS Name: disodium (3-hydroxy-4-nitroso-7-sulfonatooxy-2-naphthalenyl) sulfate IUPAC Name: disodium (3-hydroxy-4-nitroso-7-sulfonatooxynaphthalen-2-yl) sulfate Traditional Name: disodium (3-hydroxy-4-nitroso-7-sulfato-2-naphthyl) sulfate Formula: C10H5NNa2O10S2 MolecularWeight: 409.25694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2C=C1OS(=O)(=O)[O-])OS(=O)(=O)[O-])O)N=O.[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C(=C(C=C2C=C1OS(=O)(=O)[O-])OS(=O)(=O)[O-])O)N=O.[Na+].[Na+]

InChI

InChI=1S/C10H7NO10S2.2Na/c12-10-8(21-23(17,18)19)4-5-3-6(20-22(14,15)16)1-2-7(5)9(10)11-13;;/h1-4,12H,(H,14,15,16)(H,17,18,19);;/q;2*+1/p-2