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

Systemtic Name: 4-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]butan-2-one Openeye Name: 4-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]butan-2-one CAS Name: 4-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-2-butanone IUPAC Name: 4-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]butan-2-one Traditional Name: 4-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]butan-2-one Formula: C19H30O2 MolecularWeight: 290.4403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O2/c1-5-6-7-8-13-19(3,4)17-12-11-16(18(21)14-17)10-9-15(2)20/h11-12,14,21H,5-10,13H2,1-4H3