1-(1-adamantyl)-3-(5-methyl-2-oxidanyl-phenyl)propane-1,3-dione

Systemtic Name: 1-(1-adamantyl)-3-(5-methyl-2-oxidanyl-phenyl)propane-1,3-dione Openeye Name: 1-(1-adamantyl)-3-(2-hydroxy-5-methyl-phenyl)propane-1,3-dione CAS Name: 1-(1-adamantyl)-3-(2-hydroxy-5-methylphenyl)propane-1,3-dione IUPAC Name: 1-(1-adamantyl)-3-(2-hydroxy-5-methylphenyl)propane-1,3-dione Traditional Name: 1-(1-adamantyl)-3-(2-hydroxy-5-methyl-phenyl)propane-1,3-dione Formula: C20H24O3 MolecularWeight: 312.40276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)CC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)CC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H24O3/c1-12-2-3-17(21)16(4-12)18(22)8-19(23)20-9-13-5-14(10-20)7-15(6-13)11-20/h2-4,13-15,21H,5-11H2,1H3