[(2R,3S)-2-oxidanyl-3-phenylmethoxy-hex-5-enyl] benzoate

Systemtic Name: [(2R,3S)-2-oxidanyl-3-phenylmethoxy-hex-5-enyl] benzoate Openeye Name: [(2R,3S)-3-benzyloxy-2-hydroxy-hex-5-enyl] benzoate CAS Name: benzoic acid [(2R,3S)-2-hydroxy-3-phenylmethoxyhex-5-enyl] ester IUPAC Name: [(2R,3S)-2-hydroxy-3-phenylmethoxyhex-5-enyl] benzoate Traditional Name: benzoic acid [(2R,3S)-3-benzoxy-2-hydroxy-hex-5-enyl] ester Formula: C20H22O4 MolecularWeight: 326.38628

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(COC(=O)C1=CC=CC=C1)O)OCC2=CC=CC=C2

Isomeric SMILES

C=CC[C@@H]([C@@H](COC(=O)C1=CC=CC=C1)O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22O4/c1-2-9-19(23-14-16-10-5-3-6-11-16)18(21)15-24-20(22)17-12-7-4-8-13-17/h2-8,10-13,18-19,21H,1,9,14-15H2/t18-,19+/m1/s1