[5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)ethenyl]phenyl]sulfonyl sulfate

Systemtic Name: [5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)ethenyl]phenyl]sulfonyl sulfate Openeye Name: [5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)vinyl]phenyl]sulfonyl sulfate CAS Name: [5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)ethenyl]phenyl]sulfonyl sulfate IUPAC Name: [5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)ethenyl]phenyl]sulfonyl sulfate Traditional Name: [5-isothiocyanato-2-[(E)-2-(4-isothiocyanatophenyl)vinyl]phenyl]sulfonyl sulfate Formula: C16H9N2O6S4- MolecularWeight: 453.51246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=C(C=C(C=C2)N=C=S)S(=O)(=O)OS(=O)(=O)[O-])N=C=S

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=C(C=C(C=C2)N=C=S)S(=O)(=O)OS(=O)(=O)[O-])N=C=S

InChI

InChI=1S/C16H10N2O6S4/c19-27(20,24-28(21,22)23)16-9-15(18-11-26)8-5-13(16)4-1-12-2-6-14(7-3-12)17-10-25/h1-9H,(H,21,22,23)/p-1/b4-1+