(4-cyanophenyl) 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: (4-cyanophenyl) 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: (4-cyanophenyl) 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid (4-cyanophenyl) ester Formula: C16H12ClNO2S MolecularWeight: 317.78998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)OC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H12ClNO2S/c17-13-3-7-15(8-4-13)21-10-9-16(19)20-14-5-1-12(11-18)2-6-14/h1-8H,9-10H2