(4-cyano-2-methoxy-phenyl) 2-(4-methylphenyl)sulfanylethanoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-(4-methylphenyl)sulfanylethanoate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-(p-tolylsulfanyl)acetate CAS Name: 2-[(4-methylphenyl)thio]acetic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-(4-methylphenyl)sulfanylacetate Traditional Name: 2-(p-tolylthio)acetic acid (4-cyano-2-methoxy-phenyl) ester Formula: C17H15NO3S MolecularWeight: 313.3709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)OC2=C(C=C(C=C2)C#N)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)OC2=C(C=C(C=C2)C#N)OC

InChI

InChI=1S/C17H15NO3S/c1-12-3-6-14(7-4-12)22-11-17(19)21-15-8-5-13(10-18)9-16(15)20-2/h3-9H,11H2,1-2H3