(2-chlorophenyl)methylsulfanyl 4-oxidanylidenepentanoate

Systemtic Name: (2-chlorophenyl)methylsulfanyl 4-oxidanylidenepentanoate Openeye Name: (2-chlorophenyl)methylsulfanyl 4-oxopentanoate CAS Name: 4-oxopentanoic acid [(2-chlorophenyl)methylthio] ester IUPAC Name: (2-chlorophenyl)methylsulfanyl 4-oxopentanoate Traditional Name: 4-ketovaleric acid [(2-chlorobenzyl)thio] ester Formula: C12H13ClO3S MolecularWeight: 272.74782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OSCC1=CC=CC=C1Cl

Isomeric SMILES

CC(=O)CCC(=O)OSCC1=CC=CC=C1Cl

InChI

InChI=1S/C12H13ClO3S/c1-9(14)6-7-12(15)16-17-8-10-4-2-3-5-11(10)13/h2-5H,6-8H2,1H3