1-ethanoyl-4,5-bis(oxidanyl)-2-(2,4,6-trimethylphenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 1-ethanoyl-4,5-bis(oxidanyl)-2-(2,4,6-trimethylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 1-acetyl-4,5-dihydroxy-2-(2,4,6-trimethylphenyl)cyclohexanecarboxylic acid CAS Name: 1-acetyl-4,5-dihydroxy-2-(2,4,6-trimethylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 1-acetyl-4,5-dihydroxy-2-(2,4,6-trimethylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 1-acetyl-4,5-dihydroxy-2-mesityl-cyclohexanecarboxylic acid Formula: C18H24O5 MolecularWeight: 320.38016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2CC(C(CC2(C(=O)C)C(=O)O)O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2CC(C(CC2(C(=O)C)C(=O)O)O)O)C

InChI

InChI=1S/C18H24O5/c1-9-5-10(2)16(11(3)6-9)13-7-14(20)15(21)8-18(13,12(4)19)17(22)23/h5-6,13-15,20-21H,7-8H2,1-4H3,(H,22,23)