1,3,7,9-tetrakis(chloranyl)-2,8-bis-(4-methylphenyl)sulfonyl-phenoxathiine

Systemtic Name: 1,3,7,9-tetrakis(chloranyl)-2,8-bis-(4-methylphenyl)sulfonyl-phenoxathiine Openeye Name: 1,3,7,9-tetrachloro-2,8-bis(p-tolylsulfonyl)phenoxathiine CAS Name: 1,3,7,9-tetrachloro-2,8-bis-(4-methylphenyl)sulfonylphenoxathiine IUPAC Name: 1,3,7,9-tetrachloro-2,8-bis-(4-methylphenyl)sulfonylphenoxathiine Traditional Name: 1,3,7,9-tetrachloro-2,8-ditosyl-phenoxathiine Formula: C26H16Cl4O5S3 MolecularWeight: 646.40924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C3C(=C2Cl)SC4=C(C(=C(C=C4O3)Cl)S(=O)(=O)C5=CC=C(C=C5)C)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C3C(=C2Cl)SC4=C(C(=C(C=C4O3)Cl)S(=O)(=O)C5=CC=C(C=C5)C)Cl)Cl

InChI

InChI=1S/C26H16Cl4O5S3/c1-13-3-7-15(8-4-13)37(31,32)25-17(27)11-19-23(21(25)29)36-24-20(35-19)12-18(28)26(22(24)30)38(33,34)16-9-5-14(2)6-10-16/h3-12H,1-2H3