methyl 2-[2-(3-cyanophenoxy)ethylsulfanyl]ethanoate

Systemtic Name: methyl 2-[2-(3-cyanophenoxy)ethylsulfanyl]ethanoate Openeye Name: methyl 2-[2-(3-cyanophenoxy)ethylsulfanyl]acetate CAS Name: 2-[2-(3-cyanophenoxy)ethylthio]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-cyanophenoxy)ethylsulfanyl]acetate Traditional Name: 2-[2-(3-cyanophenoxy)ethylthio]acetic acid methyl ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCCOC1=CC=CC(=C1)C#N

Isomeric SMILES

COC(=O)CSCCOC1=CC=CC(=C1)C#N

InChI

InChI=1S/C12H13NO3S/c1-15-12(14)9-17-6-5-16-11-4-2-3-10(7-11)8-13/h2-4,7H,5-6,9H2,1H3