trisodium 3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate

Systemtic Name: trisodium 3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate Openeye Name: trisodium 3,4-dihydroxy-9,10-dioxo-anthracene-2-sulfonate CAS Name: trisodium 3,4-dihydroxy-9,10-dioxo-2-anthracenesulfonate IUPAC Name: trisodium 3,4-dihydroxy-9,10-dioxoanthracene-2-sulfonate Traditional Name: trisodium 3,4-dihydroxy-9,10-diketo-anthracene-2-sulfonate Formula: C14H7Na3O7S+2 MolecularWeight: 388.23549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C14H8O7S.3Na/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18;;;/h1-5,17-18H,(H,19,20,21);;;/q;3*+1/p-1