(2R,3R,5E)-3-oxidanyl-2-propyl-3,7,8,9-tetrahydro-2H-oxecine-4,10-dione

Systemtic Name: (2R,3R,5E)-3-oxidanyl-2-propyl-3,7,8,9-tetrahydro-2H-oxecine-4,10-dione Openeye Name: (2R,3R,5E)-3-hydroxy-2-propyl-3,7,8,9-tetrahydro-2H-oxecine-4,10-dione CAS Name: (2R,3R,5E)-3-hydroxy-2-propyl-3,7,8,9-tetrahydro-2H-oxecin-4,10-dione IUPAC Name: (2R,3R,5E)-3-hydroxy-2-propyl-3,7,8,9-tetrahydro-2H-oxecine-4,10-dione Traditional Name: (2R,3R,5E)-3-hydroxy-2-propyl-3,7,8,9-tetrahydro-2H-oxecin-4,10-quinone Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=O)C=CCCCC(=O)O1)O

Isomeric SMILES

CCC[C@@H]1[C@H](C(=O)/C=C/CCCC(=O)O1)O

InChI

InChI=1S/C12H18O4/c1-2-6-10-12(15)9(13)7-4-3-5-8-11(14)16-10/h4,7,10,12,15H,2-3,5-6,8H2,1H3/b7-4+/t10-,12+/m1/s1