2-(hydroxymethyl)-5-[(E)-octadec-9-enoxy]-1-(phenylmethyl)pyridin-4-one

Systemtic Name: 2-(hydroxymethyl)-5-[(E)-octadec-9-enoxy]-1-(phenylmethyl)pyridin-4-one Openeye Name: 1-benzyl-2-(hydroxymethyl)-5-[(E)-octadec-9-enoxy]pyridin-4-one CAS Name: 2-(hydroxymethyl)-5-[(E)-octadec-9-enoxy]-1-(phenylmethyl)-4-pyridinone IUPAC Name: 1-benzyl-2-(hydroxymethyl)-5-[(E)-octadec-9-enoxy]pyridin-4-one Traditional Name: 1-benzyl-2-methylol-5-[(E)-octadec-9-enoxy]-4-pyridone Formula: C31H47NO3 MolecularWeight: 481.70978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC1=CN(C(=CC1=O)CO)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC1=CN(C(=CC1=O)CO)CC2=CC=CC=C2

InChI

InChI=1S/C31H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-35-31-26-32(29(27-33)24-30(31)34)25-28-21-18-17-19-22-28/h9-10,17-19,21-22,24,26,33H,2-8,11-16,20,23,25,27H2,1H3/b10-9+