6-tert-butyl-2-oxidanyl-3-(2,4,6-trimethylphenyl)pyran-4-one

Systemtic Name: 6-tert-butyl-2-oxidanyl-3-(2,4,6-trimethylphenyl)pyran-4-one Openeye Name: 6-tert-butyl-2-hydroxy-3-(2,4,6-trimethylphenyl)pyran-4-one CAS Name: 6-tert-butyl-2-hydroxy-3-(2,4,6-trimethylphenyl)-4-pyranone IUPAC Name: 6-tert-butyl-2-hydroxy-3-(2,4,6-trimethylphenyl)pyran-4-one Traditional Name: 6-tert-butyl-2-hydroxy-3-mesityl-pyran-4-one Formula: C18H22O3 MolecularWeight: 286.36548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C(OC(=CC2=O)C(C)(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C(OC(=CC2=O)C(C)(C)C)O)C

InChI

InChI=1S/C18H22O3/c1-10-7-11(2)15(12(3)8-10)16-13(19)9-14(18(4,5)6)21-17(16)20/h7-9,20H,1-6H3