[4-(1,3-dithiolan-2-yl)phenyl] 4-bromanylbenzenesulfonate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-bromanylbenzenesulfonate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C15H13BrO3S3 MolecularWeight: 417.36092

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H13BrO3S3/c16-12-3-7-14(8-4-12)22(17,18)19-13-5-1-11(2-6-13)15-20-9-10-21-15/h1-8,15H,9-10H2