methyl 2-(2-cyano-3-methoxy-phenyl)sulfanylethanoate

Systemtic Name: methyl 2-(2-cyano-3-methoxy-phenyl)sulfanylethanoate Openeye Name: methyl 2-(2-cyano-3-methoxy-phenyl)sulfanylacetate CAS Name: 2-[(2-cyano-3-methoxyphenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-cyano-3-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(2-cyano-3-methoxy-phenyl)thio]acetic acid methyl ester Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)SCC(=O)OC)C#N

Isomeric SMILES

COC1=C(C(=CC=C1)SCC(=O)OC)C#N

InChI

InChI=1S/C11H11NO3S/c1-14-9-4-3-5-10(8(9)6-12)16-7-11(13)15-2/h3-5H,7H2,1-2H3