[5-[(1S,2S)-2-methyl-1-oxidanyl-3-oxidanylidene-octyl]furan-2-yl]methyl ethanoate

Systemtic Name: [5-[(1S,2S)-2-methyl-1-oxidanyl-3-oxidanylidene-octyl]furan-2-yl]methyl ethanoate Openeye Name: [5-[(1S,2S)-1-hydroxy-2-methyl-3-oxo-octyl]-2-furyl]methyl acetate CAS Name: acetic acid [5-[(1S,2S)-1-hydroxy-2-methyl-3-oxooctyl]-2-furanyl]methyl ester IUPAC Name: [5-[(1S,2S)-1-hydroxy-2-methyl-3-oxooctyl]furan-2-yl]methyl acetate Traditional Name: acetic acid [5-[(1S,2S)-1-hydroxy-3-keto-2-methyl-octyl]-2-furyl]methyl ester Formula: C16H24O5 MolecularWeight: 296.35876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C)C(C1=CC=C(O1)COC(=O)C)O

Isomeric SMILES

CCCCCC(=O)[C@@H](C)[C@@H](C1=CC=C(O1)COC(=O)C)O

InChI

InChI=1S/C16H24O5/c1-4-5-6-7-14(18)11(2)16(19)15-9-8-13(21-15)10-20-12(3)17/h8-9,11,16,19H,4-7,10H2,1-3H3/t11-,16+/m1/s1