dimethyl 2-[[6-(2,4-dichlorophenyl)-6-oxidanyl-hexyl]sulfanylmethyl]-2-oxidanyl-butanedioate

Systemtic Name: dimethyl 2-[[6-(2,4-dichlorophenyl)-6-oxidanyl-hexyl]sulfanylmethyl]-2-oxidanyl-butanedioate Openeye Name: dimethyl 2-[[6-(2,4-dichlorophenyl)-6-hydroxy-hexyl]sulfanylmethyl]-2-hydroxy-butanedioate CAS Name: 2-[[[6-(2,4-dichlorophenyl)-6-hydroxyhexyl]thio]methyl]-2-hydroxybutanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[6-(2,4-dichlorophenyl)-6-hydroxyhexyl]sulfanylmethyl]-2-hydroxybutanedioate Traditional Name: 2-[[[6-(2,4-dichlorophenyl)-6-hydroxy-hexyl]thio]methyl]-2-hydroxy-succinic acid dimethyl ester Formula: C19H26Cl2O6S MolecularWeight: 453.37714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CSCCCCCC(C1=C(C=C(C=C1)Cl)Cl)O)(C(=O)OC)O

Isomeric SMILES

COC(=O)CC(CSCCCCCC(C1=C(C=C(C=C1)Cl)Cl)O)(C(=O)OC)O

InChI

InChI=1S/C19H26Cl2O6S/c1-26-17(23)11-19(25,18(24)27-2)12-28-9-5-3-4-6-16(22)14-8-7-13(20)10-15(14)21/h7-8,10,16,22,25H,3-6,9,11-12H2,1-2H3