[(2S,3S)-3-chloranyl-2-oxidanyl-4-(phenylcarbonyloxy)butyl] benzoate

Systemtic Name: [(2S,3S)-3-chloranyl-2-oxidanyl-4-(phenylcarbonyloxy)butyl] benzoate Openeye Name: [(2S,3S)-4-benzoyloxy-3-chloro-2-hydroxy-butyl] benzoate CAS Name: benzoic acid [(2S,3S)-4-benzoyloxy-3-chloro-2-hydroxybutyl] ester IUPAC Name: [(2S,3S)-4-benzoyloxy-3-chloro-2-hydroxybutyl] benzoate Traditional Name: benzoic acid [(2S,3S)-4-benzoyloxy-3-chloro-2-hydroxy-butyl] ester Formula: C18H17ClO5 MolecularWeight: 348.77758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(C(COC(=O)C2=CC=CC=C2)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC[C@@H]([C@H](COC(=O)C2=CC=CC=C2)Cl)O

InChI

InChI=1S/C18H17ClO5/c19-15(11-23-17(21)13-7-3-1-4-8-13)16(20)12-24-18(22)14-9-5-2-6-10-14/h1-10,15-16,20H,11-12H2/t15-,16-/m0/s1