3,5-bis(iodanyl)-4-isothiocyanato-benzenesulfonic acid

Systemtic Name: 3,5-bis(iodanyl)-4-isothiocyanato-benzenesulfonic acid Openeye Name: 3,5-diiodo-4-isothiocyanato-benzenesulfonic acid CAS Name: 3,5-diiodo-4-isothiocyanatobenzenesulfonic acid IUPAC Name: 3,5-diiodo-4-isothiocyanatobenzenesulfonic acid Traditional Name: 3,5-diiodo-4-isothiocyanato-besylic acid Formula: C7H3I2NO3S2 MolecularWeight: 467.04256

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)N=C=S)I)S(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1I)N=C=S)I)S(=O)(=O)O

InChI

InChI=1S/C7H3I2NO3S2/c8-5-1-4(15(11,12)13)2-6(9)7(5)10-3-14/h1-2H,(H,11,12,13)