disodium 5-oxidanyl-6-sulfonatooxy-indole-1-sulfonate

Systemtic Name: disodium 5-oxidanyl-6-sulfonatooxy-indole-1-sulfonate Openeye Name: disodium 5-hydroxy-6-sulfonatooxy-indole-1-sulfonate CAS Name: disodium 5-hydroxy-6-sulfonatooxy-1-indolesulfonate IUPAC Name: disodium 5-hydroxy-6-sulfonatooxyindole-1-sulfonate Traditional Name: disodium 5-hydroxy-6-sulfato-indole-1-sulfonate Formula: C8H5NNa2O8S2 MolecularWeight: 353.23674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C2=CC(=C(C=C21)O)OS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CN(C2=CC(=C(C=C21)O)OS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H7NO8S2.2Na/c10-7-3-5-1-2-9(18(11,12)13)6(5)4-8(7)17-19(14,15)16;;/h1-4,10H,(H,11,12,13)(H,14,15,16);;/q;2*+1/p-2