2-(4-chlorophenyl)sulfanylethyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C17H17ClO4S2 MolecularWeight: 384.89748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClO4S2/c1-12-3-8-15(24(2,20)21)11-16(12)17(19)22-9-10-23-14-6-4-13(18)5-7-14/h3-8,11H,9-10H2,1-2H3