methyl (1R,5S)-3-acetyloxy-1-methyl-5-(phenylmethoxymethyl)-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylate

Systemtic Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(phenylmethoxymethyl)-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylate Openeye Name: methyl (1R,5S)-3-acetoxy-5-(benzyloxymethyl)-1-methyl-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylate CAS Name: (1R,5S)-3-acetyloxy-1-methyl-5-(phenylmethoxymethyl)-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-acetyloxy-1-methyl-5-(phenylmethoxymethyl)-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylate Traditional Name: (1R,5S)-3-acetoxy-5-(benzoxymethyl)-1-methyl-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylic acid methyl ester Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2(CCCC(C1)(O2)COCC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC(=O)OC1=C([C@]2(CCC[C@@](C1)(O2)COCC3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C21H26O6/c1-15(22)26-17-12-21(14-25-13-16-8-5-4-6-9-16)11-7-10-20(2,27-21)18(17)19(23)24-3/h4-6,8-9H,7,10-14H2,1-3H3/t20-,21+/m1/s1