sodium 1-(2-iodanylethylsulfonyl)-2-methoxy-4-oxidanidylperoxysulfanyl-benzene

Systemtic Name: sodium 1-(2-iodanylethylsulfonyl)-2-methoxy-4-oxidanidylperoxysulfanyl-benzene Openeye Name: sodium 1-(2-iodoethylsulfonyl)-2-methoxy-4-oxidoperoxysulfanyl-benzene CAS Name: sodium 4-(2-iodoethylsulfonyl)-3-methoxybenzenesulfenic acid oxidooxy ester IUPAC Name: sodium 1-(2-iodoethylsulfonyl)-2-methoxy-4-oxidoperoxysulfanylbenzene Traditional Name: sodium 1-(2-iodoethylsulfonyl)-2-methoxy-4-(oxidoperoxythio)benzene Formula: C9H10INaO6S2 MolecularWeight: 428.19634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SOO[O-])S(=O)(=O)CCI.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)SOO[O-])S(=O)(=O)CCI.[Na+]

InChI

InChI=1S/C9H11IO6S2.Na/c1-14-8-6-7(17-16-15-11)2-3-9(8)18(12,13)5-4-10;/h2-3,6,11H,4-5H2,1H3;/q;+1/p-1