(1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-dione

Systemtic Name: (1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-dione Openeye Name: (1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-dione CAS Name: (1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-dione IUPAC Name: (1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-dione Traditional Name: (1S,14S)-13-oxabicyclo[12.4.0]octadecane-3,12-quinone Formula: C17H28O3 MolecularWeight: 280.40242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(=O)OC2CCCCC2CC(=O)CCC1

Isomeric SMILES

C1CCCCC(=O)O[C@H]2CCCC[C@H]2CC(=O)CCC1

InChI

InChI=1S/C17H28O3/c18-15-10-5-3-1-2-4-6-12-17(19)20-16-11-8-7-9-14(16)13-15/h14,16H,1-13H2/t14-,16-/m0/s1