N-[(E,4S,5R)-1,5-bis(oxidanyl)icos-6-en-4-yl]ethanamide

Systemtic Name: N-[(E,4S,5R)-1,5-bis(oxidanyl)icos-6-en-4-yl]ethanamide Openeye Name: N-[(E,1S,2R)-2-hydroxy-1-(3-hydroxypropyl)heptadec-3-enyl]acetamide CAS Name: N-[(E,4S,5R)-1,5-dihydroxyeicos-6-en-4-yl]acetamide IUPAC Name: N-[(E,4S,5R)-1,5-dihydroxyicos-6-en-4-yl]acetamide Traditional Name: N-[(E,1S,2R)-2-hydroxy-1-(3-hydroxypropyl)heptadec-3-enyl]acetamide Formula: C22H43NO3 MolecularWeight: 369.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CCCO)NC(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CCCO)NC(=O)C)O

InChI

InChI=1S/C22H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22(26)21(17-16-19-24)23-20(2)25/h15,18,21-22,24,26H,3-14,16-17,19H2,1-2H3,(H,23,25)/b18-15+/t21-,22+/m0/s1