2-(2-fluorophenyl)sulfanylethyl 3-cyanobenzoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 3-cyanobenzoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C16H12FNO2S MolecularWeight: 301.335383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)F)SCCOC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)F)SCCOC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H12FNO2S/c17-14-6-1-2-7-15(14)21-9-8-20-16(19)13-5-3-4-12(10-13)11-18/h1-7,10H,8-9H2