[(2S)-2,4-dimethyl-4-oxidanyl-pentyl] 2,4,6-tris(chloranyl)benzoate

Systemtic Name: [(2S)-2,4-dimethyl-4-oxidanyl-pentyl] 2,4,6-tris(chloranyl)benzoate Openeye Name: [(2S)-4-hydroxy-2,4-dimethyl-pentyl] 2,4,6-trichlorobenzoate CAS Name: 2,4,6-trichlorobenzoic acid [(2S)-4-hydroxy-2,4-dimethylpentyl] ester IUPAC Name: [(2S)-4-hydroxy-2,4-dimethylpentyl] 2,4,6-trichlorobenzoate Traditional Name: 2,4,6-trichlorobenzoic acid [(2S)-4-hydroxy-2,4-dimethyl-pentyl] ester Formula: C14H17Cl3O3 MolecularWeight: 339.64198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)O)COC(=O)C1=C(C=C(C=C1Cl)Cl)Cl

Isomeric SMILES

C[C@@H](CC(C)(C)O)COC(=O)C1=C(C=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C14H17Cl3O3/c1-8(6-14(2,3)19)7-20-13(18)12-10(16)4-9(15)5-11(12)17/h4-5,8,19H,6-7H2,1-3H3/t8-/m0/s1