(2-cyanophenyl)methyl (2R)-2-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: (2-cyanophenyl)methyl (2R)-2-(4-methylphenyl)sulfanylpropanoate Openeye Name: (2-cyanophenyl)methyl (2R)-2-(p-tolylsulfanyl)propanoate CAS Name: (2R)-2-[(4-methylphenyl)thio]propanoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl (2R)-2-(4-methylphenyl)sulfanylpropanoate Traditional Name: (2R)-2-(p-tolylthio)propionic acid (2-cyanobenzyl) ester Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)OCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC=C(C=C1)S[C@H](C)C(=O)OCC2=CC=CC=C2C#N

InChI

InChI=1S/C18H17NO2S/c1-13-7-9-17(10-8-13)22-14(2)18(20)21-12-16-6-4-3-5-15(16)11-19/h3-10,14H,12H2,1-2H3/t14-/m1/s1