(2,6-dimethylphenyl) 3-(4-chlorophenyl)sulfonylpropanoate

Systemtic Name: (2,6-dimethylphenyl) 3-(4-chlorophenyl)sulfonylpropanoate Openeye Name: (2,6-dimethylphenyl) 3-(4-chlorophenyl)sulfonylpropanoate CAS Name: 3-(4-chlorophenyl)sulfonylpropanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-(4-chlorophenyl)sulfonylpropanoate Traditional Name: 3-(4-chlorophenyl)sulfonylpropionic acid (2,6-dimethylphenyl) ester Formula: C17H17ClO4S MolecularWeight: 352.83248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClO4S/c1-12-4-3-5-13(2)17(12)22-16(19)10-11-23(20,21)15-8-6-14(18)7-9-15/h3-9H,10-11H2,1-2H3