disodium 9,10-bis(oxidanylidene)anthracene-1,5-disulfonate hydrate

Systemtic Name: disodium 9,10-bis(oxidanylidene)anthracene-1,5-disulfonate hydrate Openeye Name: disodium 9,10-dioxoanthracene-1,5-disulfonate hydrate CAS Name: disodium 9,10-dioxoanthracene-1,5-disulfonate hydrate IUPAC Name: disodium 9,10-dioxoanthracene-1,5-disulfonate hydrate Traditional Name: disodium 9,10-diketoanthracene-1,5-disulfonate hydrate Formula: C14H8Na2O9S2 MolecularWeight: 430.31746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8O8S2.2Na.H2O/c15-13-7-3-1-5-9(23(17,18)19)11(7)14(16)8-4-2-6-10(12(8)13)24(20,21)22;;;/h1-6H,(H,17,18,19)(H,20,21,22);;;1H2/q;2*+1;/p-2