disodium 4,8-bis(azanyl)-1,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2,6-disulfonate

Systemtic Name: disodium 4,8-bis(azanyl)-1,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2,6-disulfonate Openeye Name: disodium 4,8-diamino-1,5-dihydroxy-9,10-dioxo-anthracene-2,6-disulfonate CAS Name: disodium 4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracene-2,6-disulfonate IUPAC Name: disodium 4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracene-2,6-disulfonate Traditional Name: disodium 4,8-diamino-1,5-dihydroxy-9,10-diketo-anthracene-2,6-disulfonate Formula: C14H8N2Na2O10S2 MolecularWeight: 474.33026

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(C(=C1S(=O)(=O)[O-])O)C(=O)C3=C(C2=O)C(=C(C=C3N)S(=O)(=O)[O-])O)N.[Na+].[Na+]

Isomeric SMILES

C1=C(C2=C(C(=C1S(=O)(=O)[O-])O)C(=O)C3=C(C2=O)C(=C(C=C3N)S(=O)(=O)[O-])O)N.[Na+].[Na+]

InChI

InChI=1S/C14H10N2O10S2.2Na/c15-3-1-5(27(21,22)23)11(17)9-7(3)13(19)10-8(14(9)20)4(16)2-6(12(10)18)28(24,25)26;;/h1-2,17-18H,15-16H2,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2