methyl 4-(4-sulfanylphenyl)butanoate

Systemtic Name: methyl 4-(4-sulfanylphenyl)butanoate Openeye Name: methyl 4-(4-sulfanylphenyl)butanoate CAS Name: 4-(4-mercaptophenyl)butanoic acid methyl ester IUPAC Name: methyl 4-(4-sulfanylphenyl)butanoate Traditional Name: 4-(4-mercaptophenyl)butyric acid methyl ester Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)S

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)S

InChI

InChI=1S/C11H14O2S/c1-13-11(12)4-2-3-9-5-7-10(14)8-6-9/h5-8,14H,2-4H2,1H3