sodium 6-azanyl-3-phenyldiazenyl-2-sulfo-benzenesulfonate

Systemtic Name: sodium 6-azanyl-3-phenyldiazenyl-2-sulfo-benzenesulfonate Openeye Name: sodium 6-amino-3-phenylazo-2-sulfo-benzenesulfonate CAS Name: sodium 6-amino-3-phenyldiazenyl-2-sulfobenzenesulfonate IUPAC Name: sodium 6-amino-3-phenyldiazenyl-2-sulfobenzenesulfonate Traditional Name: sodium 6-amino-3-phenylazo-2-sulfo-besylate Formula: C12H10N3NaO6S2 MolecularWeight: 379.34407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C(C(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C(C(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]

InChI

InChI=1S/C12H11N3O6S2.Na/c13-9-6-7-10(15-14-8-4-2-1-3-5-8)12(23(19,20)21)11(9)22(16,17)18;/h1-7H,13H2,(H,16,17,18)(H,19,20,21);/q;+1/p-1