[1-(2-bromanylpropyl)cyclopropyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(2-bromanylpropyl)cyclopropyl] 4-methylbenzenesulfonate Openeye Name: [1-(2-bromopropyl)cyclopropyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(2-bromopropyl)cyclopropyl] ester IUPAC Name: [1-(2-bromopropyl)cyclopropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-(2-bromopropyl)cyclopropyl] ester Formula: C13H17BrO3S MolecularWeight: 333.24128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2(CC2)CC(C)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2(CC2)CC(C)Br

InChI

InChI=1S/C13H17BrO3S/c1-10-3-5-12(6-4-10)18(15,16)17-13(7-8-13)9-11(2)14/h3-6,11H,7-9H2,1-2H3