(9E,12E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-15-oxidanyl-octadeca-9,12-dienamide

Systemtic Name: (9E,12E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-15-oxidanyl-octadeca-9,12-dienamide Openeye Name: (9E,12E)-15-hydroxy-N-[(4-hydroxy-3-methoxy-phenyl)methyl]octadeca-9,12-dienamide CAS Name: (9E,12E)-15-hydroxy-N-[(4-hydroxy-3-methoxyphenyl)methyl]octadeca-9,12-dienamide IUPAC Name: (9E,12E)-15-hydroxy-N-[(4-hydroxy-3-methoxyphenyl)methyl]octadeca-9,12-dienamide Traditional Name: (9E,12E)-15-hydroxy-N-vanillyl-octadeca-9,12-dienamide Formula: C26H41NO4 MolecularWeight: 431.60804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC=CCC=CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC)O

Isomeric SMILES

CCCC(C/C=C/C/C=C/CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C26H41NO4/c1-3-15-23(28)16-13-11-9-7-5-4-6-8-10-12-14-17-26(30)27-21-22-18-19-24(29)25(20-22)31-2/h5,7,11,13,18-20,23,28-29H,3-4,6,8-10,12,14-17,21H2,1-2H3,(H,27,30)/b7-5+,13-11+