methyl 3-ethanoyl-2,5-dimethyl-6-oxidanyl-benzoate

Systemtic Name: methyl 3-ethanoyl-2,5-dimethyl-6-oxidanyl-benzoate Openeye Name: methyl 5-acetyl-2-hydroxy-3,6-dimethyl-benzoate CAS Name: 5-acetyl-2-hydroxy-3,6-dimethylbenzoic acid methyl ester IUPAC Name: methyl 5-acetyl-2-hydroxy-3,6-dimethylbenzoate Traditional Name: 5-acetyl-2-hydroxy-3,6-dimethyl-benzoic acid methyl ester Formula: C12H14O4 MolecularWeight: 222.23716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O4/c1-6-5-9(8(3)13)7(2)10(11(6)14)12(15)16-4/h5,14H,1-4H3