methyl 5-(4-chlorophenyl)sulfanylpentanoate

Systemtic Name: methyl 5-(4-chlorophenyl)sulfanylpentanoate Openeye Name: methyl 5-(4-chlorophenyl)sulfanylpentanoate CAS Name: 5-[(4-chlorophenyl)thio]pentanoic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)sulfanylpentanoate Traditional Name: 5-[(4-chlorophenyl)thio]valeric acid methyl ester Formula: C12H15ClO2S MolecularWeight: 258.7643

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

COC(=O)CCCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H15ClO2S/c1-15-12(14)4-2-3-9-16-11-7-5-10(13)6-8-11/h5-8H,2-4,9H2,1H3