(4-tert-butylcyclohexyl) (2S,3R)-5-oxidanylidene-2-phenyl-oxolane-3-carboxylate

Systemtic Name: (4-tert-butylcyclohexyl) (2S,3R)-5-oxidanylidene-2-phenyl-oxolane-3-carboxylate Openeye Name: (4-tert-butylcyclohexyl) (2S,3R)-5-oxo-2-phenyl-tetrahydrofuran-3-carboxylate CAS Name: (2S,3R)-5-oxo-2-phenyl-3-oxolanecarboxylic acid (4-tert-butylcyclohexyl) ester IUPAC Name: (4-tert-butylcyclohexyl) (2S,3R)-5-oxo-2-phenyloxolane-3-carboxylate Traditional Name: (2S,3R)-5-keto-2-phenyl-tetrahydrofuran-3-carboxylic acid (4-tert-butylcyclohexyl) ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)C2CC(=O)OC2C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)[C@@H]2CC(=O)O[C@@H]2C3=CC=CC=C3

InChI

InChI=1S/C21H28O4/c1-21(2,3)15-9-11-16(12-10-15)24-20(23)17-13-18(22)25-19(17)14-7-5-4-6-8-14/h4-8,15-17,19H,9-13H2,1-3H3/t15?,16?,17-,19-/m1/s1