disodium (4-methyl-2-oxidanylidene-6-sulfonatooxy-chromen-7-yl) sulfate

Systemtic Name: disodium (4-methyl-2-oxidanylidene-6-sulfonatooxy-chromen-7-yl) sulfate Openeye Name: disodium (4-methyl-2-oxo-6-sulfonatooxy-chromen-7-yl) sulfate CAS Name: disodium (4-methyl-2-oxo-6-sulfonatooxy-1-benzopyran-7-yl) sulfate IUPAC Name: disodium (4-methyl-2-oxo-6-sulfonatooxychromen-7-yl) sulfate Traditional Name: disodium (2-keto-4-methyl-6-sulfato-chromen-7-yl) sulfate Formula: C10H6Na2O10S2 MolecularWeight: 396.25818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H8O10S2.2Na/c1-5-2-10(11)18-7-4-9(20-22(15,16)17)8(3-6(5)7)19-21(12,13)14;;/h2-4H,1H3,(H,12,13,14)(H,15,16,17);;/q;2*+1/p-2