ethyl 2-[(1S,2E)-2-[2-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)ethylidene]cyclopentyl]ethanoate

Systemtic Name: ethyl 2-[(1S,2E)-2-[2-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)ethylidene]cyclopentyl]ethanoate Openeye Name: ethyl 2-[(1S,2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)ethylidene]cyclopentyl]acetate CAS Name: 2-[(1S,2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)ethylidene]cyclopentyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1S,2E)-2-[2-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)ethylidene]cyclopentyl]acetate Traditional Name: 2-[(1S,2E)-2-[2-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)ethylidene]cyclopentyl]acetic acid ethyl ester Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCC1=CCC2=C(C3=C(COC3=O)C(=C2OC)C)O

Isomeric SMILES

CCOC(=O)C[C@@H]\1CCC/C1=C\CC2=C(C3=C(COC3=O)C(=C2OC)C)O

InChI

InChI=1S/C21H26O6/c1-4-26-17(22)10-14-7-5-6-13(14)8-9-15-19(23)18-16(11-27-21(18)24)12(2)20(15)25-3/h8,14,23H,4-7,9-11H2,1-3H3/b13-8+/t14-/m0/s1