[(2R)-4,4-bis(bromanyl)-2-methyl-but-3-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-4,4-bis(bromanyl)-2-methyl-but-3-enyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-4,4-dibromo-2-methyl-but-3-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-4,4-dibromo-2-methylbut-3-enyl] ester IUPAC Name: [(2R)-4,4-dibromo-2-methylbut-3-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-4,4-dibromo-2-methyl-but-3-enyl] ester Formula: C12H14Br2O3S MolecularWeight: 398.11076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C=C(Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C)C=C(Br)Br

InChI

InChI=1S/C12H14Br2O3S/c1-9-3-5-11(6-4-9)18(15,16)17-8-10(2)7-12(13)14/h3-7,10H,8H2,1-2H3/t10-/m1/s1