[(4R)-6-oxidanylnon-1-en-8-yn-4-yl] benzoate

Systemtic Name: [(4R)-6-oxidanylnon-1-en-8-yn-4-yl] benzoate Openeye Name: [(1R)-1-allyl-3-hydroxy-hex-5-ynyl] benzoate CAS Name: benzoic acid [(4R)-6-hydroxynon-1-en-8-yn-4-yl] ester IUPAC Name: [(4R)-6-hydroxynon-1-en-8-yn-4-yl] benzoate Traditional Name: benzoic acid [(1R)-1-allyl-3-hydroxy-hex-5-ynyl] ester Formula: C16H18O3 MolecularWeight: 258.31232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC(CC#C)O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H18O3/c1-3-8-14(17)12-15(9-4-2)19-16(18)13-10-6-5-7-11-13/h1,4-7,10-11,14-15,17H,2,8-9,12H2/t14?,15-/m1/s1