sodium [2-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl] sulfate

Systemtic Name: sodium [2-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl] sulfate Openeye Name: sodium (2-hydroxy-9,10-dioxo-1-anthryl) sulfate CAS Name: sodium (2-hydroxy-9,10-dioxo-1-anthracenyl) sulfate IUPAC Name: sodium (2-hydroxy-9,10-dioxoanthracen-1-yl) sulfate Traditional Name: sodium (2-hydroxy-9,10-diketo-1-anthryl) sulfate Formula: C14H7NaO7S MolecularWeight: 342.25595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H8O7S.Na/c15-10-6-5-9-11(14(10)21-22(18,19)20)13(17)8-4-2-1-3-7(8)12(9)16;/h1-6,15H,(H,18,19,20);/q;+1/p-1