[(2R,4R)-1,5-bis(chloranyl)-4-oxidanyl-pentan-2-yl] benzoate

Systemtic Name: [(2R,4R)-1,5-bis(chloranyl)-4-oxidanyl-pentan-2-yl] benzoate Openeye Name: [(1R,3R)-4-chloro-1-(chloromethyl)-3-hydroxy-butyl] benzoate CAS Name: benzoic acid [(2R,4R)-1,5-dichloro-4-hydroxypentan-2-yl] ester IUPAC Name: [(2R,4R)-1,5-dichloro-4-hydroxypentan-2-yl] benzoate Traditional Name: benzoic acid [(1R,3R)-4-chloro-1-(chloromethyl)-3-hydroxy-butyl] ester Formula: C12H14Cl2O3 MolecularWeight: 277.14376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(CC(CCl)O)CCl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@H](C[C@H](CCl)O)CCl

InChI

InChI=1S/C12H14Cl2O3/c13-7-10(15)6-11(8-14)17-12(16)9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2/t10-,11-/m1/s1