2-(4-chlorophenyl)sulfanylethyl 4-methylsulfonylbenzoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 4-methylsulfonylbenzoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C16H15ClO4S2 MolecularWeight: 370.8709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClO4S2/c1-23(19,20)15-8-2-12(3-9-15)16(18)21-10-11-22-14-6-4-13(17)5-7-14/h2-9H,10-11H2,1H3