methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylmethoxypropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate

Systemtic Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylmethoxypropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate Openeye Name: methyl (1R,5S)-3-acetoxy-5-(3-benzyloxypropyl)-1-methyl-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate CAS Name: (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylmethoxypropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylmethoxypropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate Traditional Name: (1R,5S)-3-acetoxy-5-(3-benzoxypropyl)-1-methyl-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester Formula: C22H28O6 MolecularWeight: 388.45412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2(CCC(C1)(O2)CCCOCC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC(=O)OC1=C([C@]2(CC[C@@](C1)(O2)CCCOCC3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C22H28O6/c1-16(23)27-18-14-22(10-7-13-26-15-17-8-5-4-6-9-17)12-11-21(2,28-22)19(18)20(24)25-3/h4-6,8-9H,7,10-15H2,1-3H3/t21-,22+/m1/s1