[(2S)-8-oxidanyl-1-phenylmethoxy-oct-4-yn-2-yl] benzoate

Systemtic Name: [(2S)-8-oxidanyl-1-phenylmethoxy-oct-4-yn-2-yl] benzoate Openeye Name: [(1S)-1-(benzyloxymethyl)-7-hydroxy-hept-3-ynyl] benzoate CAS Name: benzoic acid [(2S)-8-hydroxy-1-phenylmethoxyoct-4-yn-2-yl] ester IUPAC Name: [(2S)-8-hydroxy-1-phenylmethoxyoct-4-yn-2-yl] benzoate Traditional Name: benzoic acid [(1S)-1-(benzoxymethyl)-7-hydroxy-hept-3-ynyl] ester Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CC#CCCCO)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C22H24O4/c23-16-10-2-1-9-15-21(18-25-17-19-11-5-3-6-12-19)26-22(24)20-13-7-4-8-14-20/h3-8,11-14,21,23H,2,10,15-18H2/t21-/m0/s1