N-[(3-methoxy-4-oxidanyl-phenyl)methyl]hexadec-9-ynamide

Systemtic Name: N-[(3-methoxy-4-oxidanyl-phenyl)methyl]hexadec-9-ynamide Openeye Name: N-[(4-hydroxy-3-methoxy-phenyl)methyl]hexadec-9-ynamide CAS Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-hexadecynamide IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]hexadec-9-ynamide Traditional Name: N-vanillylhexadec-9-ynamide Formula: C24H37NO3 MolecularWeight: 387.55548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC

Isomeric SMILES

CCCCCCC#CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C24H37NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(27)25-20-21-17-18-22(26)23(19-21)28-2/h17-19,26H,3-7,10-16,20H2,1-2H3,(H,25,27)