dizinc; [2,3-bis(bromanyl)-6-(phenylcarbamoyl)phenyl] hypobromite; prop-2-enoate

Systemtic Name: dizinc; [2,3-bis(bromanyl)-6-(phenylcarbamoyl)phenyl] hypobromite; prop-2-enoate Openeye Name: dizinc; [2,3-dibromo-6-(phenylcarbamoyl)phenyl] hypobromite; prop-2-enoate CAS Name: dizinc; hypobromous acid [6-[anilino(oxo)methyl]-2,3-dibromophenyl] ester; 2-propenoate IUPAC Name: dizinc; [2,3-dibromo-6-(phenylcarbamoyl)phenyl] hypobromite; prop-2-enoate Traditional Name: dizinc; acrylate; hypobromous acid [2,3-dibromo-6-(phenylcarbamoyl)phenyl] ester Formula: C16H11Br3NO4Zn2+3 MolecularWeight: 651.79284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8Br3NO2.C3H4O2.2Zn/c14-10-7-6-9(12(19-16)11(10)15)13(18)17-8-4-2-1-3-5-8;1-2-3(4)5;;/h1-7H,(H,17,18);2H,1H2,(H,4,5);;/q;;2*+2/p-1