(4-cyanophenyl)methyl 2-phenylsulfanylethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-phenylsulfanylethanoate Openeye Name: (4-cyanophenyl)methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid (4-cyanobenzyl) ester Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO2S/c17-10-13-6-8-14(9-7-13)11-19-16(18)12-20-15-4-2-1-3-5-15/h1-9H,11-12H2