methyl 3-cyano-4-[2-(2,4-dichlorophenyl)ethylsulfanyl]-3-oxidanyl-butanoate

Systemtic Name: methyl 3-cyano-4-[2-(2,4-dichlorophenyl)ethylsulfanyl]-3-oxidanyl-butanoate Openeye Name: methyl 3-cyano-4-[2-(2,4-dichlorophenyl)ethylsulfanyl]-3-hydroxy-butanoate CAS Name: 3-cyano-4-[2-(2,4-dichlorophenyl)ethylthio]-3-hydroxybutanoic acid methyl ester IUPAC Name: methyl 3-cyano-4-[2-(2,4-dichlorophenyl)ethylsulfanyl]-3-hydroxybutanoate Traditional Name: 3-cyano-4-[2-(2,4-dichlorophenyl)ethylthio]-3-hydroxy-butyric acid methyl ester Formula: C14H15Cl2NO3S MolecularWeight: 348.2448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CSCCC1=C(C=C(C=C1)Cl)Cl)(C#N)O

Isomeric SMILES

COC(=O)CC(CSCCC1=C(C=C(C=C1)Cl)Cl)(C#N)O

InChI

InChI=1S/C14H15Cl2NO3S/c1-20-13(18)7-14(19,8-17)9-21-5-4-10-2-3-11(15)6-12(10)16/h2-3,6,19H,4-5,7,9H2,1H3