dimethyl 1,3,7,9-tetrakis(chloranyl)phenoxathiine-2,8-dicarboxylate

Systemtic Name: dimethyl 1,3,7,9-tetrakis(chloranyl)phenoxathiine-2,8-dicarboxylate Openeye Name: dimethyl 1,3,7,9-tetrachlorophenoxathiine-2,8-dicarboxylate CAS Name: 1,3,7,9-tetrachlorophenoxathiine-2,8-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1,3,7,9-tetrachlorophenoxathiine-2,8-dicarboxylate Traditional Name: 1,3,7,9-tetrachlorophenoxathiine-2,8-dicarboxylic acid dimethyl ester Formula: C16H8Cl4O5S MolecularWeight: 454.10872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C2C(=C1Cl)SC3=C(C(=C(C=C3O2)Cl)C(=O)OC)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(C=C2C(=C1Cl)SC3=C(C(=C(C=C3O2)Cl)C(=O)OC)Cl)Cl

InChI

InChI=1S/C16H8Cl4O5S/c1-23-15(21)9-5(17)3-7-13(11(9)19)26-14-8(25-7)4-6(18)10(12(14)20)16(22)24-2/h3-4H,1-2H3