methyl 4-[bis(4-chlorophenyl)methylsulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-[bis(4-chlorophenyl)methylsulfanyl]-3-oxidanylidene-butanoate Openeye Name: methyl 4-[bis(4-chlorophenyl)methylsulfanyl]-3-oxo-butanoate CAS Name: 4-[bis(4-chlorophenyl)methylthio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[bis(4-chlorophenyl)methylsulfanyl]-3-oxobutanoate Traditional Name: 4-[bis(4-chlorophenyl)methylthio]-3-keto-butyric acid methyl ester Formula: C18H16Cl2O3S MolecularWeight: 383.28884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CSC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CC(=O)CSC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H16Cl2O3S/c1-23-17(22)10-16(21)11-24-18(12-2-6-14(19)7-3-12)13-4-8-15(20)9-5-13/h2-9,18H,10-11H2,1H3