(2-chloranyl-4-cyano-phenyl) 4-methylsulfonylbenzenesulfonate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 4-methylsulfonylbenzenesulfonate Openeye Name: (2-chloro-4-cyano-phenyl) 4-methylsulfonylbenzenesulfonate CAS Name: 4-methylsulfonylbenzenesulfonic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 4-methylsulfonylbenzenesulfonate Traditional Name: 4-mesylbenzenesulfonic acid (2-chloro-4-cyano-phenyl) ester Formula: C14H10ClNO5S2 MolecularWeight: 371.8159

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C14H10ClNO5S2/c1-22(17,18)11-3-5-12(6-4-11)23(19,20)21-14-7-2-10(9-16)8-13(14)15/h2-8H,1H3