methyl 2-(4-methoxyphenyl)-2-thiocyanato-ethanoate

Systemtic Name: methyl 2-(4-methoxyphenyl)-2-thiocyanato-ethanoate Openeye Name: methyl 2-(4-methoxyphenyl)-2-thiocyanato-acetate CAS Name: 2-(4-methoxyphenyl)-2-thiocyanatoacetic acid methyl ester IUPAC Name: methyl 2-(4-methoxyphenyl)-2-thiocyanatoacetate Traditional Name: 2-(4-methoxyphenyl)-2-thiocyanato-acetic acid methyl ester Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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