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

Systemtic Name: N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]-2-oxidanyl-butanamide Openeye Name: 2-hydroxy-N-[(E)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]butanamide CAS Name: N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]-2-hydroxybutanamide IUPAC Name: N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]-2-hydroxybutanamide Traditional Name: 2-hydroxy-N-[(E)-2-hydroxy-1-methylol-heptadec-3-enyl]butyramide Formula: C22H43NO4 MolecularWeight: 385.58112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H43NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21(26)19(18-24)23-22(27)20(25)4-2/h16-17,19-21,24-26H,3-15,18H2,1-2H3,(H,23,27)/b17-16+