5-[[6-[(E)-3-oxidanylundec-1-enyl]pyridin-2-yl]methyl]oxolan-2-one

Systemtic Name: 5-[[6-[(E)-3-oxidanylundec-1-enyl]pyridin-2-yl]methyl]oxolan-2-one Openeye Name: 5-[[6-[(E)-3-hydroxyundec-1-enyl]-2-pyridyl]methyl]tetrahydrofuran-2-one CAS Name: 5-[[6-[(E)-3-hydroxyundec-1-enyl]-2-pyridinyl]methyl]-2-oxolanone IUPAC Name: 5-[[6-[(E)-3-hydroxyundec-1-enyl]pyridin-2-yl]methyl]oxolan-2-one Traditional Name: 5-[[6-[(E)-3-hydroxyundec-1-enyl]-2-pyridyl]methyl]tetrahydrofuran-2-one Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC1=NC(=CC=C1)CC2CCC(=O)O2)O

Isomeric SMILES

CCCCCCCCC(/C=C/C1=NC(=CC=C1)CC2CCC(=O)O2)O

InChI

InChI=1S/C21H31NO3/c1-2-3-4-5-6-7-11-19(23)13-12-17-9-8-10-18(22-17)16-20-14-15-21(24)25-20/h8-10,12-13,19-20,23H,2-7,11,14-16H2,1H3/b13-12+