methyl 3-(4-cyanophenyl)sulfanylpropanoate

Systemtic Name: methyl 3-(4-cyanophenyl)sulfanylpropanoate Openeye Name: methyl 3-(4-cyanophenyl)sulfanylpropanoate CAS Name: 3-[(4-cyanophenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4-cyanophenyl)sulfanylpropanoate Traditional Name: 3-[(4-cyanophenyl)thio]propionic acid methyl ester Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=CC=C(C=C1)C#N

Isomeric SMILES

COC(=O)CCSC1=CC=C(C=C1)C#N

InChI

InChI=1S/C11H11NO2S/c1-14-11(13)6-7-15-10-4-2-9(8-12)3-5-10/h2-5H,6-7H2,1H3