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

Systemtic Name: (9E,12E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-15-methyl-octadeca-9,12-dienamide Openeye Name: (9E,12E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-15-methyl-octadeca-9,12-dienamide CAS Name: (9E,12E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-15-methyloctadeca-9,12-dienamide IUPAC Name: (9E,12E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-15-methyloctadeca-9,12-dienamide Traditional Name: (9E,12E)-15-methyl-N-vanillyl-octadeca-9,12-dienamide Formula: C27H43NO3 MolecularWeight: 429.63522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H43NO3/c1-4-16-23(2)17-14-12-10-8-6-5-7-9-11-13-15-18-27(30)28-22-24-19-20-25(29)26(21-24)31-3/h6,8,12,14,19-21,23,29H,4-5,7,9-11,13,15-18,22H2,1-3H3,(H,28,30)/b8-6+,14-12+