[4,4-bis(chloranyl)-2-(4-nitrophenyl)-2-oxidanyl-butyl] bromanylmethanesulfonate

Systemtic Name: [4,4-bis(chloranyl)-2-(4-nitrophenyl)-2-oxidanyl-butyl] bromanylmethanesulfonate Openeye Name: [4,4-dichloro-2-hydroxy-2-(4-nitrophenyl)butyl] bromomethanesulfonate CAS Name: bromomethanesulfonic acid [4,4-dichloro-2-hydroxy-2-(4-nitrophenyl)butyl] ester IUPAC Name: [4,4-dichloro-2-hydroxy-2-(4-nitrophenyl)butyl] bromomethanesulfonate Traditional Name: bromomethanesulfonic acid [4,4-dichloro-2-hydroxy-2-(4-nitrophenyl)butyl] ester Formula: C11H12BrCl2NO6S MolecularWeight: 437.09108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(Cl)Cl)(COS(=O)(=O)CBr)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CC(Cl)Cl)(COS(=O)(=O)CBr)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12BrCl2NO6S/c12-7-22(19,20)21-6-11(16,5-10(13)14)8-1-3-9(4-2-8)15(17)18/h1-4,10,16H,5-7H2