5-[(3R)-2,2-dimethyl-5-oxidanyl-4-oxidanylidene-7-pentyl-3H-chromen-3-yl]pentane-2,3-dione

Systemtic Name: 5-[(3R)-2,2-dimethyl-5-oxidanyl-4-oxidanylidene-7-pentyl-3H-chromen-3-yl]pentane-2,3-dione Openeye Name: 5-[(3R)-5-hydroxy-2,2-dimethyl-4-oxo-7-pentyl-chroman-3-yl]pentane-2,3-dione CAS Name: 5-[(3R)-5-hydroxy-2,2-dimethyl-4-oxo-7-pentyl-3,4-dihydro-2H-1-benzopyran-3-yl]pentane-2,3-dione IUPAC Name: 5-[(3R)-5-hydroxy-2,2-dimethyl-4-oxo-7-pentyl-3H-chromen-3-yl]pentane-2,3-dione Traditional Name: 5-[(3R)-7-amyl-5-hydroxy-4-keto-2,2-dimethyl-chroman-3-yl]pentane-2,3-dione Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)O)C(=O)C(C(O2)(C)C)CCC(=O)C(=O)C

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)O)C(=O)[C@@H](C(O2)(C)C)CCC(=O)C(=O)C

InChI

InChI=1S/C21H28O5/c1-5-6-7-8-14-11-17(24)19-18(12-14)26-21(3,4)15(20(19)25)9-10-16(23)13(2)22/h11-12,15,24H,5-10H2,1-4H3/t15-/m0/s1