6-[(2R,4R)-2,4-bis(oxidanyl)hept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one

Systemtic Name: 6-[(2R,4R)-2,4-bis(oxidanyl)hept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one Openeye Name: 6-[(2R,4R)-2,4-dihydroxyhept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one CAS Name: 6-[(2R,4R)-2,4-dihydroxyhept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one IUPAC Name: 6-[(2R,4R)-2,4-dihydroxyhept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one Traditional Name: 6-[(2R,4R)-2,4-dihydroxyhept-6-ynyl]-2,2-dimethyl-1,3-dioxin-4-one Formula: C13H18O5 MolecularWeight: 254.27902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=O)O1)CC(CC(CC#C)O)O)C

Isomeric SMILES

CC1(OC(=CC(=O)O1)C[C@@H](C[C@@H](CC#C)O)O)C

InChI

InChI=1S/C13H18O5/c1-4-5-9(14)6-10(15)7-11-8-12(16)18-13(2,3)17-11/h1,8-10,14-15H,5-7H2,2-3H3/t9-,10-/m1/s1