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

Systemtic Name: 4-azanyl-N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]butanamide Openeye Name: 4-amino-N-[(E)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]butanamide CAS Name: 4-amino-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]butanamide IUPAC Name: 4-amino-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]butanamide Traditional Name: 4-amino-N-[(E)-2-hydroxy-1-methylol-heptadec-3-enyl]butyramide Formula: C22H44N2O3 MolecularWeight: 384.59636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H44N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-21(26)20(19-25)24-22(27)17-15-18-23/h14,16,20-21,25-26H,2-13,15,17-19,23H2,1H3,(H,24,27)/b16-14+