2-(hydroxymethyl)-5-icosoxy-1-(phenylmethyl)pyridin-4-one

Systemtic Name: 2-(hydroxymethyl)-5-icosoxy-1-(phenylmethyl)pyridin-4-one Openeye Name: 1-benzyl-2-(hydroxymethyl)-5-icosoxy-pyridin-4-one CAS Name: 5-eicosoxy-2-(hydroxymethyl)-1-(phenylmethyl)-4-pyridinone IUPAC Name: 1-benzyl-2-(hydroxymethyl)-5-icosoxypyridin-4-one Traditional Name: 5-arachyloxy-1-benzyl-2-methylol-4-pyridone Formula: C33H53NO3 MolecularWeight: 511.77882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CO)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CO)CC2=CC=CC=C2

InChI

InChI=1S/C33H53NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-37-33-28-34(31(29-35)26-32(33)36)27-30-23-20-19-21-24-30/h19-21,23-24,26,28,35H,2-18,22,25,27,29H2,1H3