N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]-2-bromanyl-ethanamide

Systemtic Name: N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]-2-bromanyl-ethanamide Openeye Name: 2-bromo-N-[(E)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]acetamide CAS Name: 2-bromo-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]acetamide IUPAC Name: 2-bromo-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]acetamide Traditional Name: 2-bromo-N-[(E)-2-hydroxy-1-methylol-heptadec-3-enyl]acetamide Formula: C20H38BrNO3 MolecularWeight: 420.42462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)NC(=O)CBr)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(CO)NC(=O)CBr)O

InChI

InChI=1S/C20H38BrNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(24)18(17-23)22-20(25)16-21/h14-15,18-19,23-24H,2-13,16-17H2,1H3,(H,22,25)/b15-14+