ethyl 2-[4-(bromomethyl)phenyl]propane-2-sulfonate

Systemtic Name: ethyl 2-[4-(bromomethyl)phenyl]propane-2-sulfonate Openeye Name: ethyl 2-[4-(bromomethyl)phenyl]propane-2-sulfonate CAS Name: 2-[4-(bromomethyl)phenyl]-2-propanesulfonic acid IUPAC Name: ethyl 2-[4-(bromomethyl)phenyl]propane-2-sulfonate Traditional Name: 2-[4-(bromomethyl)phenyl]propane-2-sulfonic acid ethyl ester Formula: C12H17BrO3S MolecularWeight: 321.23058

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C(C)(C)C1=CC=C(C=C1)CBr

Isomeric SMILES

CCOS(=O)(=O)C(C)(C)C1=CC=C(C=C1)CBr

InChI

InChI=1S/C12H17BrO3S/c1-4-16-17(14,15)12(2,3)11-7-5-10(9-13)6-8-11/h5-8H,4,9H2,1-3H3