[(1R)-1-[(2R)-5-oxidanylideneoxolan-2-yl]non-2-ynyl] benzoate

Systemtic Name: [(1R)-1-[(2R)-5-oxidanylideneoxolan-2-yl]non-2-ynyl] benzoate Openeye Name: [(1R)-1-[(2R)-5-oxotetrahydrofuran-2-yl]non-2-ynyl] benzoate CAS Name: benzoic acid [(1R)-1-[(2R)-5-oxo-2-oxolanyl]non-2-ynyl] ester IUPAC Name: [(1R)-1-[(2R)-5-oxooxolan-2-yl]non-2-ynyl] benzoate Traditional Name: benzoic acid [(1R)-1-[(2R)-5-ketotetrahydrofuran-2-yl]non-2-ynyl] ester Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C1CCC(=O)O1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC#C[C@H]([C@H]1CCC(=O)O1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H24O4/c1-2-3-4-5-6-10-13-17(18-14-15-19(21)23-18)24-20(22)16-11-8-7-9-12-16/h7-9,11-12,17-18H,2-6,14-15H2,1H3/t17-,18-/m1/s1