2-methyl-1-[3-(2-methylbutanoyl)-2,4,6-tris(oxidanyl)phenyl]butan-1-one

Systemtic Name: 2-methyl-1-[3-(2-methylbutanoyl)-2,4,6-tris(oxidanyl)phenyl]butan-1-one Openeye Name: 2-methyl-1-[2,4,6-trihydroxy-3-(2-methylbutanoyl)phenyl]butan-1-one CAS Name: 2-methyl-1-[2,4,6-trihydroxy-3-(2-methyl-1-oxobutyl)phenyl]-1-butanone IUPAC Name: 2-methyl-1-[2,4,6-trihydroxy-3-(2-methylbutanoyl)phenyl]butan-1-one Traditional Name: 2-methyl-1-[2,4,6-trihydroxy-3-(2-methylbutanoyl)phenyl]butan-1-one Formula: C16H22O5 MolecularWeight: 294.34288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C1=C(C(=C(C=C1O)O)C(=O)C(C)CC)O

Isomeric SMILES

CCC(C)C(=O)C1=C(C(=C(C=C1O)O)C(=O)C(C)CC)O

InChI

InChI=1S/C16H22O5/c1-5-8(3)14(19)12-10(17)7-11(18)13(16(12)21)15(20)9(4)6-2/h7-9,17-18,21H,5-6H2,1-4H3