4-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]pentan-2-one

Systemtic Name: 4-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]pentan-2-one Openeye Name: 4-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]pentan-2-one CAS Name: 4-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-2-pentanone IUPAC Name: 4-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]pentan-2-one Traditional Name: 4-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]pentan-2-one Formula: C20H32O2 MolecularWeight: 304.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C(C)CC(=O)C)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C(C)CC(=O)C)O

InChI

InChI=1S/C20H32O2/c1-6-7-8-9-12-20(4,5)17-10-11-18(19(22)14-17)15(2)13-16(3)21/h10-11,14-15,22H,6-9,12-13H2,1-5H3