3-[(2E,4E)-6-(hydroxymethyl)-4-methyl-octa-2,4-dienoyl]-2-oxidanyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-4-one

Systemtic Name: 3-[(2E,4E)-6-(hydroxymethyl)-4-methyl-octa-2,4-dienoyl]-2-oxidanyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-4-one Openeye Name: 5-(4-benzyloxyphenyl)-2-hydroxy-3-[(2E,4E)-6-(hydroxymethyl)-4-methyl-octa-2,4-dienoyl]-1H-pyridin-4-one CAS Name: 2-hydroxy-3-[(2E,4E)-6-(hydroxymethyl)-4-methyl-1-oxoocta-2,4-dienyl]-5-(4-phenylmethoxyphenyl)-1H-pyridin-4-one IUPAC Name: 2-hydroxy-3-[(2E,4E)-6-(hydroxymethyl)-4-methylocta-2,4-dienoyl]-5-(4-phenylmethoxyphenyl)-1H-pyridin-4-one Traditional Name: 5-(4-benzoxyphenyl)-2-hydroxy-3-[(2E,4E)-4-methyl-6-methylol-octa-2,4-dienoyl]-4-pyridone Formula: C28H29NO5 MolecularWeight: 459.53356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C=C(C)C=CC(=O)C1=C(NC=C(C1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CCC(CO)/C=C(\C)/C=C/C(=O)C1=C(NC=C(C1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H29NO5/c1-3-20(17-30)15-19(2)9-14-25(31)26-27(32)24(16-29-28(26)33)22-10-12-23(13-11-22)34-18-21-7-5-4-6-8-21/h4-16,20,30H,3,17-18H2,1-2H3,(H2,29,32,33)/b14-9+,19-15+