ethyl 3-[(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)methyl]-4-hexyl-cyclopent-3-ene-1-carboxylate

Systemtic Name: ethyl 3-[(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)methyl]-4-hexyl-cyclopent-3-ene-1-carboxylate Openeye Name: ethyl 3-[(4-acetoxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)methyl]-4-hexyl-cyclopent-3-ene-1-carboxylate CAS Name: 3-[(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)methyl]-4-hexyl-1-cyclopent-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)methyl]-4-hexylcyclopent-3-ene-1-carboxylate Traditional Name: 3-[(4-acetoxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)methyl]-4-hexyl-cyclopent-3-ene-1-carboxylic acid ethyl ester Formula: C27H36O7 MolecularWeight: 472.57054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(CC(C1)C(=O)OCC)CC2=C(C3=C(COC3=O)C(=C2OC)C)OC(=O)C

Isomeric SMILES

CCCCCCC1=C(CC(C1)C(=O)OCC)CC2=C(C3=C(COC3=O)C(=C2OC)C)OC(=O)C

InChI

InChI=1S/C27H36O7/c1-6-8-9-10-11-18-12-20(26(29)32-7-2)13-19(18)14-21-24(31-5)16(3)22-15-33-27(30)23(22)25(21)34-17(4)28/h20H,6-15H2,1-5H3