methyl 4-[3-(2,4-dichlorophenyl)propylsulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-[3-(2,4-dichlorophenyl)propylsulfanyl]-3-oxidanylidene-butanoate Openeye Name: methyl 4-[3-(2,4-dichlorophenyl)propylsulfanyl]-3-oxo-butanoate CAS Name: 4-[3-(2,4-dichlorophenyl)propylthio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[3-(2,4-dichlorophenyl)propylsulfanyl]-3-oxobutanoate Traditional Name: 4-[3-(2,4-dichlorophenyl)propylthio]-3-keto-butyric acid methyl ester Formula: C14H16Cl2O3S MolecularWeight: 335.24604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CSCCCC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)CC(=O)CSCCCC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H16Cl2O3S/c1-19-14(18)8-12(17)9-20-6-2-3-10-4-5-11(15)7-13(10)16/h4-5,7H,2-3,6,8-9H2,1H3