1-[3-(hydroxymethyl)-5-methyl-2-oxidanyl-phenyl]-2,2-dimethyl-pent-4-en-1-one

Systemtic Name: 1-[3-(hydroxymethyl)-5-methyl-2-oxidanyl-phenyl]-2,2-dimethyl-pent-4-en-1-one Openeye Name: 1-[2-hydroxy-3-(hydroxymethyl)-5-methyl-phenyl]-2,2-dimethyl-pent-4-en-1-one CAS Name: 1-[2-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-2,2-dimethyl-4-penten-1-one IUPAC Name: 1-[2-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-2,2-dimethylpent-4-en-1-one Traditional Name: 1-(2-hydroxy-5-methyl-3-methylol-phenyl)-2,2-dimethyl-pent-4-en-1-one Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C(C)(C)CC=C)O)CO

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)C(C)(C)CC=C)O)CO

InChI

InChI=1S/C15H20O3/c1-5-6-15(3,4)14(18)12-8-10(2)7-11(9-16)13(12)17/h5,7-8,16-17H,1,6,9H2,2-4H3