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

Systemtic Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate Openeye Name: methyl (1R,5S)-3-acetoxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate CAS Name: (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylate Traditional Name: (1R,5S)-3-acetoxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2(CCC(C1)(O2)CCCC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC(=O)OC1=C([C@]2(CC[C@@](C1)(O2)CCCC3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C21H26O5/c1-15(22)25-17-14-21(11-7-10-16-8-5-4-6-9-16)13-12-20(2,26-21)18(17)19(23)24-3/h4-6,8-9H,7,10-14H2,1-3H3/t20-,21+/m1/s1