[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(cyanomethylsulfanyl)ethanoate

Systemtic Name: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(cyanomethylsulfanyl)ethanoate Openeye Name: [2-(2-methoxyphenyl)-2-oxo-ethyl] 2-(cyanomethylsulfanyl)acetate CAS Name: 2-(cyanomethylthio)acetic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyphenyl)-2-oxoethyl] 2-(cyanomethylsulfanyl)acetate Traditional Name: 2-(cyanomethylthio)acetic acid [2-keto-2-(2-methoxyphenyl)ethyl] ester Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)COC(=O)CSCC#N

Isomeric SMILES

COC1=CC=CC=C1C(=O)COC(=O)CSCC#N

InChI

InChI=1S/C13H13NO4S/c1-17-12-5-3-2-4-10(12)11(15)8-18-13(16)9-19-7-6-14/h2-5H,7-9H2,1H3