methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-carboxylate

Systemtic Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-carboxylate Openeye Name: methyl (1R,5S)-3-acetoxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-carboxylate CAS Name: (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-carboxylate Traditional Name: (1R,5S)-3-acetoxy-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-3-ene-4-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)C)CCCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

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

InChI

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