2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 3-cyanobenzoate

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 3-cyanobenzoate Openeye Name: 2-(2,5-dichlorophenyl)sulfanylethyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester IUPAC Name: 2-(2,5-dichlorophenyl)sulfanylethyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester Formula: C16H11Cl2NO2S MolecularWeight: 352.23504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11Cl2NO2S/c17-13-4-5-14(18)15(9-13)22-7-6-21-16(20)12-3-1-2-11(8-12)10-19/h1-5,8-9H,6-7H2