disodium 7-azanylnaphthalene-1,3,6-trisulfonate

Systemtic Name: disodium 7-azanylnaphthalene-1,3,6-trisulfonate Openeye Name: disodium 7-aminonaphthalene-1,3,6-trisulfonate CAS Name: disodium 7-aminonaphthalene-1,3,6-trisulfonate IUPAC Name: disodium 7-aminonaphthalene-1,3,6-trisulfonate Traditional Name: disodium 7-aminonaphthalene-1,3,6-trisulfonate Formula: C10H6NNa2O9S3- MolecularWeight: 426.33048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO9S3.2Na/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;;/h1-4H,11H2,(H,12,13,14)(H,15,16,17)(H,18,19,20);;/q;2*+1/p-3