2-(4-chlorophenyl)sulfanylethyl 4-cyanobenzoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 4-cyanobenzoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C16H12ClNO2S MolecularWeight: 317.78998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)OCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)OCCSC2=CC=C(C=C2)Cl

InChI

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