methyl 4-[4-(2-chlorophenyl)phenyl]sulfanylbutanoate

Systemtic Name: methyl 4-[4-(2-chlorophenyl)phenyl]sulfanylbutanoate Openeye Name: methyl 4-[4-(2-chlorophenyl)phenyl]sulfanylbutanoate CAS Name: 4-[[4-(2-chlorophenyl)phenyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(2-chlorophenyl)phenyl]sulfanylbutanoate Traditional Name: 4-[[4-(2-chlorophenyl)phenyl]thio]butyric acid methyl ester Formula: C17H17ClO2S MolecularWeight: 320.83368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=CC=C(C=C1)C2=CC=CC=C2Cl

Isomeric SMILES

COC(=O)CCCSC1=CC=C(C=C1)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H17ClO2S/c1-20-17(19)7-4-12-21-14-10-8-13(9-11-14)15-5-2-3-6-16(15)18/h2-3,5-6,8-11H,4,7,12H2,1H3