butyl 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: butyl 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: butyl 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid butyl ester IUPAC Name: butyl 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid butyl ester Formula: C13H17ClO2S MolecularWeight: 272.79088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCOC(=O)CCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H17ClO2S/c1-2-3-9-16-13(15)8-10-17-12-6-4-11(14)5-7-12/h4-7H,2-3,8-10H2,1H3