5-[[3-[(E)-3-oxidanylundec-5-en-1-ynyl]phenyl]methyl]oxan-2-one

Systemtic Name: 5-[[3-[(E)-3-oxidanylundec-5-en-1-ynyl]phenyl]methyl]oxan-2-one Openeye Name: 5-[[3-[(E)-3-hydroxyundec-5-en-1-ynyl]phenyl]methyl]tetrahydropyran-2-one CAS Name: 5-[[3-[(E)-3-hydroxyundec-5-en-1-ynyl]phenyl]methyl]-2-oxanone IUPAC Name: 5-[[3-[(E)-3-hydroxyundec-5-en-1-ynyl]phenyl]methyl]oxan-2-one Traditional Name: 5-[3-[(E)-3-hydroxyundec-5-en-1-ynyl]benzyl]tetrahydropyran-2-one Formula: C23H30O3 MolecularWeight: 354.4825

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC(C#CC1=CC(=CC=C1)CC2CCC(=O)OC2)O

Isomeric SMILES

CCCCC/C=C/CC(C#CC1=CC(=CC=C1)CC2CCC(=O)OC2)O

InChI

InChI=1S/C23H30O3/c1-2-3-4-5-6-7-11-22(24)14-12-19-9-8-10-20(16-19)17-21-13-15-23(25)26-18-21/h6-10,16,21-22,24H,2-5,11,13,15,17-18H2,1H3/b7-6+