disodium 3-(4-arsonato-2-nitro-phenoxy)propane-1,2-diol

Systemtic Name: disodium 3-(4-arsonato-2-nitro-phenoxy)propane-1,2-diol Openeye Name: disodium 3-(4-arsonato-2-nitro-phenoxy)propane-1,2-diol CAS Name: disodium 3-(4-arsonato-2-nitrophenoxy)propane-1,2-diol IUPAC Name: disodium 3-(4-arsonato-2-nitrophenoxy)propane-1,2-diol Traditional Name: disodium 3-(4-arsonato-2-nitro-phenoxy)propane-1,2-diol Formula: C9H10AsNNa2O8 MolecularWeight: 381.07874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[As](=O)([O-])[O-])[N+](=O)[O-])OCC(CO)O.[Na+].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1[As](=O)([O-])[O-])[N+](=O)[O-])OCC(CO)O.[Na+].[Na+]

InChI

InChI=1S/C9H12AsNO8.2Na/c12-4-7(13)5-19-9-2-1-6(10(14,15)16)3-8(9)11(17)18;;/h1-3,7,12-13H,4-5H2,(H2,14,15,16);;/q;2*+1/p-2