(2S)-2-(bromomethyl)-8-(4-chloranylphenoxy)-2-oxidanyl-octanoate

Systemtic Name: (2S)-2-(bromomethyl)-8-(4-chloranylphenoxy)-2-oxidanyl-octanoate Openeye Name: (2S)-2-(bromomethyl)-8-(4-chlorophenoxy)-2-hydroxy-octanoate CAS Name: (2S)-2-(bromomethyl)-8-(4-chlorophenoxy)-2-hydroxyoctanoate IUPAC Name: (2S)-2-(bromomethyl)-8-(4-chlorophenoxy)-2-hydroxyoctanoate Traditional Name: (2S)-2-(bromomethyl)-8-(4-chlorophenoxy)-2-hydroxy-caprylate Formula: C15H19BrClO4- MolecularWeight: 378.66596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCCCCC(CBr)(C(=O)[O-])O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCCCC[C@@](CBr)(C(=O)[O-])O)Cl

InChI

InChI=1S/C15H20BrClO4/c16-11-15(20,14(18)19)9-3-1-2-4-10-21-13-7-5-12(17)6-8-13/h5-8,20H,1-4,9-11H2,(H,18,19)/p-1/t15-/m1/s1