[4,4,4-tris(chloranyl)-2-oxidanyl-2-phenyl-butyl] ethanesulfonate

Systemtic Name: [4,4,4-tris(chloranyl)-2-oxidanyl-2-phenyl-butyl] ethanesulfonate Openeye Name: (4,4,4-trichloro-2-hydroxy-2-phenyl-butyl) ethanesulfonate CAS Name: ethanesulfonic acid (4,4,4-trichloro-2-hydroxy-2-phenylbutyl) ester IUPAC Name: (4,4,4-trichloro-2-hydroxy-2-phenylbutyl) ethanesulfonate Traditional Name: ethanesulfonic acid (4,4,4-trichloro-2-hydroxy-2-phenyl-butyl) ester Formula: C12H15Cl3O4S MolecularWeight: 361.6691

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OCC(CC(Cl)(Cl)Cl)(C1=CC=CC=C1)O

Isomeric SMILES

CCS(=O)(=O)OCC(CC(Cl)(Cl)Cl)(C1=CC=CC=C1)O

InChI

InChI=1S/C12H15Cl3O4S/c1-2-20(17,18)19-9-11(16,8-12(13,14)15)10-6-4-3-5-7-10/h3-7,16H,2,8-9H2,1H3