1-(3-butyl-5-methyl-2-oxidanyl-phenyl)ethanone

Systemtic Name: 1-(3-butyl-5-methyl-2-oxidanyl-phenyl)ethanone Openeye Name: 1-(3-butyl-2-hydroxy-5-methyl-phenyl)ethanone CAS Name: 1-(3-butyl-2-hydroxy-5-methylphenyl)ethanone IUPAC Name: 1-(3-butyl-2-hydroxy-5-methylphenyl)ethanone Traditional Name: 1-(3-butyl-2-hydroxy-5-methyl-phenyl)ethanone Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC(=C1)C)C(=O)C)O

Isomeric SMILES

CCCCC1=C(C(=CC(=C1)C)C(=O)C)O

InChI

InChI=1S/C13H18O2/c1-4-5-6-11-7-9(2)8-12(10(3)14)13(11)15/h7-8,15H,4-6H2,1-3H3