methyl 3-[(1S,2R,3aS,8bS)-2-acetyloxy-1-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]propanoate

Systemtic Name: methyl 3-[(1S,2R,3aS,8bS)-2-acetyloxy-1-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]propanoate Openeye Name: methyl 3-[(1S,2R,3aS,8bS)-2-acetoxy-1-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]benzofuran-5-yl]propanoate CAS Name: 3-[(1S,2R,3aS,8bS)-2-acetyloxy-1-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]benzofuran-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[(1S,2R,3aS,8bS)-2-acetyloxy-1-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]propanoate Traditional Name: 3-[(1S,2R,3aS,8bS)-2-acetoxy-1-methylol-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]benzofuran-5-yl]propionic acid methyl ester Formula: C18H22O6 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2C(C1CO)C3=C(O2)C(=CC=C3)CCC(=O)OC

Isomeric SMILES

CC(=O)O[C@@H]1C[C@H]2[C@@H]([C@H]1CO)C3=C(O2)C(=CC=C3)CCC(=O)OC

InChI

InChI=1S/C18H22O6/c1-10(20)23-14-8-15-17(13(14)9-19)12-5-3-4-11(18(12)24-15)6-7-16(21)22-2/h3-5,13-15,17,19H,6-9H2,1-2H3/t13-,14+,15-,17+/m0/s1