[(1R)-1-cyanoethyl] 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: [(1R)-1-cyanoethyl] 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid [(1R)-1-cyanoethyl] ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=C(C=C(C=C1)SC)OC

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=C(C=C(C=C1)SC)OC

InChI

InChI=1S/C12H13NO3S/c1-8(7-13)16-12(14)10-5-4-9(17-3)6-11(10)15-2/h4-6,8H,1-3H3/t8-/m1/s1