trisodium 4-[(2-arsonophenyl)diazenyl]-3-oxidanidyl-naphthalene-2,7-disulfonate

Systemtic Name: trisodium 4-[(2-arsonophenyl)diazenyl]-3-oxidanidyl-naphthalene-2,7-disulfonate Openeye Name: trisodium 4-(2-arsonophenyl)azo-3-oxido-naphthalene-2,7-disulfonate CAS Name: trisodium 4-(2-arsonophenyl)azo-3-oxidonaphthalene-2,7-disulfonate IUPAC Name: trisodium 4-[(2-arsonophenyl)diazenyl]-3-oxidonaphthalene-2,7-disulfonate Traditional Name: trisodium 4-(2-arsonophenyl)azo-3-oxido-naphthalene-2,7-disulfonate Formula: C16H10AsN2Na3O10S2 MolecularWeight: 598.27891

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N=NC2=C3C=CC(=CC3=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[As](=O)(O)O.[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)N=NC2=C3C=CC(=CC3=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[As](=O)(O)O.[Na+].[Na+].[Na+]

InChI

InChI=1S/C16H13AsN2O10S2.3Na/c20-16-14(31(27,28)29)8-9-7-10(30(24,25)26)5-6-11(9)15(16)19-18-13-4-2-1-3-12(13)17(21,22)23;;;/h1-8,20H,(H2,21,22,23)(H,24,25,26)(H,27,28,29);;;/q;3*+1/p-3