[(2S,3R)-5-ethanoyl-4-fluoranyl-2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-3-yl] (Z)-2-methylbut-2-enoate

Systemtic Name: [(2S,3R)-5-ethanoyl-4-fluoranyl-2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-3-yl] (Z)-2-methylbut-2-enoate Openeye Name: [(2S,3R)-5-acetyl-4-fluoro-2-(1-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-3-yl] (Z)-2-methylbut-2-enoate CAS Name: (Z)-2-methyl-2-butenoic acid [(2S,3R)-5-acetyl-4-fluoro-2-(2-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-3-yl] ester IUPAC Name: [(2S,3R)-5-acetyl-4-fluoro-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-3-yl] (Z)-2-methylbut-2-enoate Traditional Name: (Z)-2-methylbut-2-enoic acid [(2S,3R)-5-acetyl-4-fluoro-2-(1-hydroxy-1-methyl-ethyl)coumaran-3-yl] ester Formula: C18H21FO5 MolecularWeight: 336.354743

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)OC1C(OC2=C1C(=C(C=C2)C(=O)C)F)C(C)(C)O

Isomeric SMILES

C/C=C(/C)\C(=O)O[C@H]1[C@H](OC2=C1C(=C(C=C2)C(=O)C)F)C(C)(C)O

InChI

InChI=1S/C18H21FO5/c1-6-9(2)17(21)24-15-13-12(23-16(15)18(4,5)22)8-7-11(10(3)20)14(13)19/h6-8,15-16,22H,1-5H3/b9-6-/t15-,16+/m1/s1