N-[(3-methoxy-4-oxidanyl-phenyl)methyl]nonadec-10-ynamide

Systemtic Name: N-[(3-methoxy-4-oxidanyl-phenyl)methyl]nonadec-10-ynamide Openeye Name: N-[(4-hydroxy-3-methoxy-phenyl)methyl]nonadec-10-ynamide CAS Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-10-nonadecynamide IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]nonadec-10-ynamide Traditional Name: N-vanillylnonadec-10-ynamide Formula: C27H43NO3 MolecularWeight: 429.63522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(30)28-23-24-20-21-25(29)26(22-24)31-2/h20-22,29H,3-9,12-19,23H2,1-2H3,(H,28,30)