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

Systemtic Name: 3-azanyl-N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]propanamide Openeye Name: 3-amino-N-[(E)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]propanamide CAS Name: 3-amino-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]propanamide IUPAC Name: 3-amino-N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]propanamide Traditional Name: 3-amino-N-[(E)-2-hydroxy-1-methylol-heptadec-3-enyl]propionamide Formula: C21H42N2O3 MolecularWeight: 370.56978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(25)19(18-24)23-21(26)16-17-22/h14-15,19-20,24-25H,2-13,16-18,22H2,1H3,(H,23,26)/b15-14+