methyl 4-[9-(2,4-dichlorophenyl)nonylsulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-[9-(2,4-dichlorophenyl)nonylsulfanyl]-3-oxidanylidene-butanoate Openeye Name: methyl 4-[9-(2,4-dichlorophenyl)nonylsulfanyl]-3-oxo-butanoate CAS Name: 4-[9-(2,4-dichlorophenyl)nonylthio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[9-(2,4-dichlorophenyl)nonylsulfanyl]-3-oxobutanoate Traditional Name: 4-[9-(2,4-dichlorophenyl)nonylthio]-3-keto-butyric acid methyl ester Formula: C20H28Cl2O3S MolecularWeight: 419.40552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CSCCCCCCCCCC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)CC(=O)CSCCCCCCCCCC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C20H28Cl2O3S/c1-25-20(24)14-18(23)15-26-12-8-6-4-2-3-5-7-9-16-10-11-17(21)13-19(16)22/h10-11,13H,2-9,12,14-15H2,1H3