methyl 3-[3-(3-cyanophenoxy)propylsulfanyl]propanoate

Systemtic Name: methyl 3-[3-(3-cyanophenoxy)propylsulfanyl]propanoate Openeye Name: methyl 3-[3-(3-cyanophenoxy)propylsulfanyl]propanoate CAS Name: 3-[3-(3-cyanophenoxy)propylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(3-cyanophenoxy)propylsulfanyl]propanoate Traditional Name: 3-[3-(3-cyanophenoxy)propylthio]propionic acid methyl ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCCCOC1=CC=CC(=C1)C#N

Isomeric SMILES

COC(=O)CCSCCCOC1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H17NO3S/c1-17-14(16)6-9-19-8-3-7-18-13-5-2-4-12(10-13)11-15/h2,4-5,10H,3,6-9H2,1H3