(4-chloranyl-3-ethyl-phenyl) 4-methylsulfonylbenzenesulfonate

Systemtic Name: (4-chloranyl-3-ethyl-phenyl) 4-methylsulfonylbenzenesulfonate Openeye Name: (4-chloro-3-ethyl-phenyl) 4-methylsulfonylbenzenesulfonate CAS Name: 4-methylsulfonylbenzenesulfonic acid (4-chloro-3-ethylphenyl) ester IUPAC Name: (4-chloro-3-ethylphenyl) 4-methylsulfonylbenzenesulfonate Traditional Name: 4-mesylbenzenesulfonic acid (4-chloro-3-ethyl-phenyl) ester Formula: C15H15ClO5S2 MolecularWeight: 374.8596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C15H15ClO5S2/c1-3-11-10-12(4-9-15(11)16)21-23(19,20)14-7-5-13(6-8-14)22(2,17)18/h4-10H,3H2,1-2H3