hexasodium [4-bis(4-phosphonatophenyl)phosphanylphenyl]-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane

Systemtic Name: hexasodium [4-bis(4-phosphonatophenyl)phosphanylphenyl]-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane Openeye Name: hexasodium [4-bis(4-phosphonatophenyl)phosphanylphenyl]-dioxido-oxo-$l^{5}-phosphane CAS Name: hexasodium [4-bis(4-phosphonatophenyl)phosphinophenyl]-dioxido-oxophosphorane IUPAC Name: hexasodium [4-bis(4-phosphonatophenyl)phosphanylphenyl]-dioxido-oxo-$l^{5}-phosphane Traditional Name: hexasodium [4-bis(4-phosphonatophenyl)phosphinophenyl]-keto-dioxido-phosphorane Formula: C18H12Na6O9P4 MolecularWeight: 634.116144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1P(C2=CC=C(C=C2)P(=O)([O-])[O-])C3=CC=C(C=C3)P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1P(C2=CC=C(C=C2)P(=O)([O-])[O-])C3=CC=C(C=C3)P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C18H18O9P4.6Na/c19-29(20,21)16-7-1-13(2-8-16)28(14-3-9-17(10-4-14)30(22,23)24)15-5-11-18(12-6-15)31(25,26)27;;;;;;/h1-12H,(H2,19,20,21)(H2,22,23,24)(H2,25,26,27);;;;;;/q;6*+1/p-6