3-[bis(phenylazanyl)phosphinothioyl-sulfo-amino]benzene-1,2-disulfonic acid

Systemtic Name: 3-[bis(phenylazanyl)phosphinothioyl-sulfo-amino]benzene-1,2-disulfonic acid Openeye Name: 3-[dianilinophosphinothioyl(sulfo)amino]benzene-1,2-disulfonic acid CAS Name: 3-[dianilinophosphinothioyl(sulfo)amino]benzene-1,2-disulfonic acid IUPAC Name: 3-[dianilinophosphinothioyl(sulfo)amino]benzene-1,2-disulfonic acid Traditional Name: 3-[dianilinothiophosphoryl(sulfo)amino]benzene-1,2-disulfonic acid Formula: C18H18N3O9PS4 MolecularWeight: 579.583981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NP(=S)(NC2=CC=CC=C2)N(C3=C(C(=CC=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NP(=S)(NC2=CC=CC=C2)N(C3=C(C(=CC=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H18N3O9PS4/c22-33(23,24)17-13-7-12-16(18(17)34(25,26)27)21(35(28,29)30)31(32,19-14-8-3-1-4-9-14)20-15-10-5-2-6-11-15/h1-13H,(H2,19,20,32)(H,22,23,24)(H,25,26,27)(H,28,29,30)