tetrasodium [9,10-bis(oxidanylidene)-5-(sulfonatomethylazanidylsulfonyl)anthracen-2-yl]sulfonylazanidylmethanesulfonate

Systemtic Name: tetrasodium [9,10-bis(oxidanylidene)-5-(sulfonatomethylazanidylsulfonyl)anthracen-2-yl]sulfonylazanidylmethanesulfonate Openeye Name: tetrasodium [9,10-dioxo-5-(sulfonatomethylazanidylsulfonyl)-2-anthryl]sulfonylazanidylmethanesulfonate CAS Name: tetrasodium [9,10-dioxo-5-(sulfonatomethylazanidylsulfonyl)-2-anthracenyl]sulfonylazanidylmethanesulfonate IUPAC Name: tetrasodium [9,10-dioxo-5-(sulfonatomethylazanidylsulfonyl)anthracen-2-yl]sulfonylazanidylmethanesulfonate Traditional Name: tetrasodium [9,10-diketo-5-(sulfonatomethylazanidylsulfonyl)-2-anthryl]sulfonylazanidylmethanesulfonate Formula: C16H10N2Na4O12S4 MolecularWeight: 642.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)[N-]CS(=O)(=O)[O-])C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)[N-]CS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)[N-]CS(=O)(=O)[O-])C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)[N-]CS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C16H12N2O12S4.4Na/c19-15-11-2-1-3-13(34(29,30)18-8-32(24,25)26)14(11)16(20)10-5-4-9(6-12(10)15)33(27,28)17-7-31(21,22)23;;;;/h1-6H,7-8H2,(H,21,22,23)(H,24,25,26);;;;/q-2;4*+1/p-2