(2-cyanophenyl)methyl 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid (2-cyanobenzyl) ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)OCC2=CC=CC=C2C#N

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)OCC2=CC=CC=C2C#N

InChI

InChI=1S/C17H15NO3S/c1-20-15-6-8-16(9-7-15)22-12-17(19)21-11-14-5-3-2-4-13(14)10-18/h2-9H,11-12H2,1H3