2-oxidanyl-N-[(E,2S,3R)-1,3,6-tris(oxidanyl)octadec-4-en-2-yl]benzamide

Systemtic Name: 2-oxidanyl-N-[(E,2S,3R)-1,3,6-tris(oxidanyl)octadec-4-en-2-yl]benzamide Openeye Name: N-[(E,1S,2R)-2,5-dihydroxy-1-(hydroxymethyl)heptadec-3-enyl]-2-hydroxy-benzamide CAS Name: 2-hydroxy-N-[(E,2S,3R)-1,3,6-trihydroxyoctadec-4-en-2-yl]benzamide IUPAC Name: 2-hydroxy-N-[(E,2S,3R)-1,3,6-trihydroxyoctadec-4-en-2-yl]benzamide Traditional Name: N-[(E,1S,2R)-2,5-dihydroxy-1-methylol-heptadec-3-enyl]-2-hydroxy-benzamide Formula: C25H41NO5 MolecularWeight: 435.59674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C=CC(C(CO)NC(=O)C1=CC=CC=C1O)O)O

Isomeric SMILES

CCCCCCCCCCCCC(/C=C/[C@H]([C@H](CO)NC(=O)C1=CC=CC=C1O)O)O

InChI

InChI=1S/C25H41NO5/c1-2-3-4-5-6-7-8-9-10-11-14-20(28)17-18-24(30)22(19-27)26-25(31)21-15-12-13-16-23(21)29/h12-13,15-18,20,22,24,27-30H,2-11,14,19H2,1H3,(H,26,31)/b18-17+/t20?,22-,24+/m0/s1