ethyl (2R,3R)-2-(2-methylpropyl)-3-oxidanyl-4-oxidanylidene-2,5,6,7-tetrahydro-1-benzofuran-3-carboxylate

Systemtic Name: ethyl (2R,3R)-2-(2-methylpropyl)-3-oxidanyl-4-oxidanylidene-2,5,6,7-tetrahydro-1-benzofuran-3-carboxylate Openeye Name: ethyl (2R,3R)-3-hydroxy-2-isobutyl-4-oxo-2,5,6,7-tetrahydrobenzofuran-3-carboxylate CAS Name: (2R,3R)-3-hydroxy-2-(2-methylpropyl)-4-oxo-2,5,6,7-tetrahydrobenzofuran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-hydroxy-2-(2-methylpropyl)-4-oxo-2,5,6,7-tetrahydro-1-benzofuran-3-carboxylate Traditional Name: (2R,3R)-3-hydroxy-2-isobutyl-4-keto-2,5,6,7-tetrahydrobenzofuran-3-carboxylic acid ethyl ester Formula: C15H22O5 MolecularWeight: 282.33218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(OC2=C1C(=O)CCC2)CC(C)C)O

Isomeric SMILES

CCOC(=O)[C@@]1([C@H](OC2=C1C(=O)CCC2)CC(C)C)O

InChI

InChI=1S/C15H22O5/c1-4-19-14(17)15(18)12(8-9(2)3)20-11-7-5-6-10(16)13(11)15/h9,12,18H,4-8H2,1-3H3/t12-,15+/m1/s1