tetrapotassium 2,5-bis[(4-sulfonatophenyl)diazenyl]benzene-1,3-disulfonate

Systemtic Name: tetrapotassium 2,5-bis[(4-sulfonatophenyl)diazenyl]benzene-1,3-disulfonate Openeye Name: tetrapotassium 2,5-bis[(4-sulfonatophenyl)azo]benzene-1,3-disulfonate CAS Name: tetrapotassium 2,5-bis[(4-sulfonatophenyl)azo]benzene-1,3-disulfonate IUPAC Name: tetrapotassium 2,5-bis[(4-sulfonatophenyl)diazenyl]benzene-1,3-disulfonate Traditional Name: tetrapotassium 2,5-bis[(4-sulfonatophenyl)azo]benzene-1,3-disulfonate Formula: C18H10K4N4O12S4 MolecularWeight: 758.9448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)[O-])N=NC3=CC=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+].[K+]

Isomeric SMILES

C1=CC(=CC=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)[O-])N=NC3=CC=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+].[K+]

InChI

InChI=1S/C18H14N4O12S4.4K/c23-35(24,25)14-5-1-11(2-6-14)19-21-13-9-16(37(29,30)31)18(17(10-13)38(32,33)34)22-20-12-3-7-15(8-4-12)36(26,27)28;;;;/h1-10H,(H,23,24,25)(H,26,27,28)(H,29,30,31)(H,32,33,34);;;;/q;4*+1/p-4