[4-(4-cyanophenyl)phenyl] 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C22H17NO3S MolecularWeight: 375.44028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H17NO3S/c1-25-21-13-19(27-2)11-12-20(21)22(24)26-18-9-7-17(8-10-18)16-5-3-15(14-23)4-6-16/h3-13H,1-2H3