dizinc [2,3-bis(bromanyl)-6-(phenylcarbamoyl)phenyl] hypobromite phosphate

Systemtic Name: dizinc [2,3-bis(bromanyl)-6-(phenylcarbamoyl)phenyl] hypobromite phosphate Openeye Name: dizinc [2,3-dibromo-6-(phenylcarbamoyl)phenyl] hypobromite phosphate CAS Name: dizinc hypobromous acid [6-[anilino(oxo)methyl]-2,3-dibromophenyl] ester phosphate IUPAC Name: dizinc [2,3-dibromo-6-(phenylcarbamoyl)phenyl] hypobromite phosphate Traditional Name: dizinc hypobromous acid [2,3-dibromo-6-(phenylcarbamoyl)phenyl] ester phosphate Formula: C13H8Br3NO6PZn2+ MolecularWeight: 675.709481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C(C(=C(C=C2)Br)Br)OBr.[O-]P(=O)([O-])[O-].[Zn+2].[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C(C(=C(C=C2)Br)Br)OBr.[O-]P(=O)([O-])[O-].[Zn+2].[Zn+2]

InChI

InChI=1S/C13H8Br3NO2.H3O4P.2Zn/c14-10-7-6-9(12(19-16)11(10)15)13(18)17-8-4-2-1-3-5-8;1-5(2,3)4;;/h1-7H,(H,17,18);(H3,1,2,3,4);;/q;;2*+2/p-3