2-(4-butoxybutyl)-2-methyl-3-[(1E,5E)-3-oxidanylocta-1,5-dienyl]cyclopentan-1-one

Systemtic Name: 2-(4-butoxybutyl)-2-methyl-3-[(1E,5E)-3-oxidanylocta-1,5-dienyl]cyclopentan-1-one Openeye Name: 2-(4-butoxybutyl)-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-2-methyl-cyclopentanone CAS Name: 2-(4-butoxybutyl)-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-2-methyl-1-cyclopentanone IUPAC Name: 2-(4-butoxybutyl)-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-2-methylcyclopentan-1-one Traditional Name: 2-(4-butoxybutyl)-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-2-methyl-cyclopentanone Formula: C22H38O3 MolecularWeight: 350.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCCC1(C(CCC1=O)C=CC(CC=CCC)O)C

Isomeric SMILES

CCCCOCCCCC1(C(CCC1=O)/C=C/C(C/C=C/CC)O)C

InChI

InChI=1S/C22H38O3/c1-4-6-8-11-20(23)14-12-19-13-15-21(24)22(19,3)16-9-10-18-25-17-7-5-2/h6,8,12,14,19-20,23H,4-5,7,9-11,13,15-18H2,1-3H3/b8-6+,14-12+