trisodium 8-azanylnaphthalene-1,3,6-trisulfonate

Systemtic Name: trisodium 8-azanylnaphthalene-1,3,6-trisulfonate Openeye Name: trisodium 8-aminonaphthalene-1,3,6-trisulfonate CAS Name: trisodium 8-aminonaphthalene-1,3,6-trisulfonate IUPAC Name: trisodium 8-aminonaphthalene-1,3,6-trisulfonate Traditional Name: trisodium 8-aminonaphthalene-1,3,6-trisulfonate Formula: C10H6NNa3O9S3 MolecularWeight: 449.32025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO9S3.3Na/c11-8-3-6(21(12,13)14)1-5-2-7(22(15,16)17)4-9(10(5)8)23(18,19)20;;;/h1-4H,11H2,(H,12,13,14)(H,15,16,17)(H,18,19,20);;;/q;3*+1/p-3