triazanium 5-azanylnaphthalene-1,3,6-trisulfonate

Systemtic Name: triazanium 5-azanylnaphthalene-1,3,6-trisulfonate Openeye Name: triammonium 5-aminonaphthalene-1,3,6-trisulfonate CAS Name: triammonium 5-aminonaphthalene-1,3,6-trisulfonate IUPAC Name: triazanium 5-aminonaphthalene-1,3,6-trisulfonate Traditional Name: triammonium 5-aminonaphthalene-1,3,6-trisulfonate Formula: C10H18N4O9S3 MolecularWeight: 434.46632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=CC(=CC(=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+]

Isomeric SMILES

C1=CC(=C(C2=CC(=CC(=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+]

InChI

InChI=1S/C10H9NO9S3.3H3N/c11-10-7-3-5(21(12,13)14)4-9(23(18,19)20)6(7)1-2-8(10)22(15,16)17;;;/h1-4H,11H2,(H,12,13,14)(H,15,16,17)(H,18,19,20);3*1H3