methyl 6-[4-(4-chlorophenyl)phenyl]sulfanylhexanoate

Systemtic Name: methyl 6-[4-(4-chlorophenyl)phenyl]sulfanylhexanoate Openeye Name: methyl 6-[4-(4-chlorophenyl)phenyl]sulfanylhexanoate CAS Name: 6-[[4-(4-chlorophenyl)phenyl]thio]hexanoic acid methyl ester IUPAC Name: methyl 6-[4-(4-chlorophenyl)phenyl]sulfanylhexanoate Traditional Name: 6-[[4-(4-chlorophenyl)phenyl]thio]hexanoic acid methyl ester Formula: C19H21ClO2S MolecularWeight: 348.88684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCSC1=CC=C(C=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCSC1=CC=C(C=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H21ClO2S/c1-22-19(21)5-3-2-4-14-23-18-12-8-16(9-13-18)15-6-10-17(20)11-7-15/h6-13H,2-5,14H2,1H3