[(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] ethanoate

Systemtic Name: [(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] ethanoate Openeye Name: [(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] ester IUPAC Name: [(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] acetate Traditional Name: acetic acid [(2S,3R,6R)-2-methyl-6-(2-phenylethynyl)-3,6-dihydro-2H-pyran-3-yl] ester Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C=CC(O1)C#CC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

C[C@H]1[C@@H](C=C[C@@H](O1)C#CC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C16H16O3/c1-12-16(19-13(2)17)11-10-15(18-12)9-8-14-6-4-3-5-7-14/h3-7,10-12,15-16H,1-2H3/t12-,15-,16+/m0/s1