[(2R)-1-[3-methoxy-2,5-bis(oxidanyl)phenyl]tridecan-2-yl] ethanoate

Systemtic Name: [(2R)-1-[3-methoxy-2,5-bis(oxidanyl)phenyl]tridecan-2-yl] ethanoate Openeye Name: [(1R)-1-[(2,5-dihydroxy-3-methoxy-phenyl)methyl]dodecyl] acetate CAS Name: acetic acid [(2R)-1-(2,5-dihydroxy-3-methoxyphenyl)tridecan-2-yl] ester IUPAC Name: [(2R)-1-(2,5-dihydroxy-3-methoxyphenyl)tridecan-2-yl] acetate Traditional Name: acetic acid [(1R)-1-(2,5-dihydroxy-3-methoxy-benzyl)dodecyl] ester Formula: C22H36O5 MolecularWeight: 380.51824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC1=CC(=CC(=C1O)OC)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCC[C@H](CC1=CC(=CC(=C1O)OC)O)OC(=O)C

InChI

InChI=1S/C22H36O5/c1-4-5-6-7-8-9-10-11-12-13-20(27-17(2)23)15-18-14-19(24)16-21(26-3)22(18)25/h14,16,20,24-25H,4-13,15H2,1-3H3/t20-/m1/s1