ethyl (2R,3R,6R)-6-cyclohexyl-4-oxidanylidene-2-phenethyl-oxane-3-carboxylate

Systemtic Name: ethyl (2R,3R,6R)-6-cyclohexyl-4-oxidanylidene-2-phenethyl-oxane-3-carboxylate Openeye Name: ethyl (2R,3R,6R)-6-cyclohexyl-4-oxo-2-phenethyl-tetrahydropyran-3-carboxylate CAS Name: (2R,3R,6R)-6-cyclohexyl-4-oxo-2-phenethyl-3-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R,6R)-6-cyclohexyl-4-oxo-2-phenethyloxane-3-carboxylate Traditional Name: (2R,3R,6R)-6-cyclohexyl-4-keto-2-phenethyl-tetrahydropyran-3-carboxylic acid ethyl ester Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(OC(CC1=O)C2CCCCC2)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](O[C@H](CC1=O)C2CCCCC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H30O4/c1-2-25-22(24)21-18(23)15-20(17-11-7-4-8-12-17)26-19(21)14-13-16-9-5-3-6-10-16/h3,5-6,9-10,17,19-21H,2,4,7-8,11-15H2,1H3/t19-,20-,21+/m1/s1