diethyl 2-[6-(2,4-dichlorophenyl)hexylsulfanylmethyl]-2-oxidanyl-butanedioate

Systemtic Name: diethyl 2-[6-(2,4-dichlorophenyl)hexylsulfanylmethyl]-2-oxidanyl-butanedioate Openeye Name: diethyl 2-[6-(2,4-dichlorophenyl)hexylsulfanylmethyl]-2-hydroxy-butanedioate CAS Name: 2-[[6-(2,4-dichlorophenyl)hexylthio]methyl]-2-hydroxybutanedioic acid diethyl ester IUPAC Name: diethyl 2-[6-(2,4-dichlorophenyl)hexylsulfanylmethyl]-2-hydroxybutanedioate Traditional Name: 2-[[6-(2,4-dichlorophenyl)hexylthio]methyl]-2-hydroxy-succinic acid diethyl ester Formula: C21H30Cl2O5S MolecularWeight: 465.4309

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CSCCCCCCC1=C(C=C(C=C1)Cl)Cl)(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)CC(CSCCCCCCC1=C(C=C(C=C1)Cl)Cl)(C(=O)OCC)O

InChI

InChI=1S/C21H30Cl2O5S/c1-3-27-19(24)14-21(26,20(25)28-4-2)15-29-12-8-6-5-7-9-16-10-11-17(22)13-18(16)23/h10-11,13,26H,3-9,12,14-15H2,1-2H3