methyl 3-(2-acetyloxy-3,7-dimethyl-3-oxidanyl-oct-6-enyl)-4-oxidanyl-benzoate

Systemtic Name: methyl 3-(2-acetyloxy-3,7-dimethyl-3-oxidanyl-oct-6-enyl)-4-oxidanyl-benzoate Openeye Name: methyl 3-(2-acetoxy-3-hydroxy-3,7-dimethyl-oct-6-enyl)-4-hydroxy-benzoate CAS Name: 3-(2-acetyloxy-3-hydroxy-3,7-dimethyloct-6-enyl)-4-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-(2-acetyloxy-3-hydroxy-3,7-dimethyloct-6-enyl)-4-hydroxybenzoate Traditional Name: 3-(2-acetoxy-3-hydroxy-3,7-dimethyl-oct-6-enyl)-4-hydroxy-benzoic acid methyl ester Formula: C20H28O6 MolecularWeight: 364.43272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C(CC1=C(C=CC(=C1)C(=O)OC)O)OC(=O)C)O)C

Isomeric SMILES

CC(=CCCC(C)(C(CC1=C(C=CC(=C1)C(=O)OC)O)OC(=O)C)O)C

InChI

InChI=1S/C20H28O6/c1-13(2)7-6-10-20(4,24)18(26-14(3)21)12-16-11-15(19(23)25-5)8-9-17(16)22/h7-9,11,18,22,24H,6,10,12H2,1-5H3