disodium 4-[[4-(sulfonatomethylamino)phenyl]diazenyl]benzenesulfonate

Systemtic Name: disodium 4-[[4-(sulfonatomethylamino)phenyl]diazenyl]benzenesulfonate Openeye Name: disodium 4-[4-(sulfonatomethylamino)phenyl]azobenzenesulfonate CAS Name: disodium 4-[4-(sulfonatomethylamino)phenyl]azobenzenesulfonate IUPAC Name: disodium 4-[[4-(sulfonatomethylamino)phenyl]diazenyl]benzenesulfonate Traditional Name: disodium 4-[4-(sulfonatomethylamino)phenyl]azobesylate Formula: C13H11N3Na2O6S2 MolecularWeight: 415.35248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C13H13N3O6S2.2Na/c17-23(18,19)9-14-10-1-3-11(4-2-10)15-16-12-5-7-13(8-6-12)24(20,21)22;;/h1-8,14H,9H2,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2