trisodium 7-oxidanylnaphthalene-1,3,6-trisulfonate

Systemtic Name: trisodium 7-oxidanylnaphthalene-1,3,6-trisulfonate Openeye Name: trisodium 7-hydroxynaphthalene-1,3,6-trisulfonate CAS Name: trisodium 7-hydroxynaphthalene-1,3,6-trisulfonate IUPAC Name: trisodium 7-hydroxynaphthalene-1,3,6-trisulfonate Traditional Name: trisodium 7-hydroxynaphthalene-1,3,6-trisulfonate Formula: C10H5Na3O10S3 MolecularWeight: 450.30501

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)[O-])O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)[O-])O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C10H8O10S3.3Na/c11-8-4-7-5(2-10(8)23(18,19)20)1-6(21(12,13)14)3-9(7)22(15,16)17;;;/h1-4,11H,(H,12,13,14)(H,15,16,17)(H,18,19,20);;;/q;3*+1/p-3