2-[1,5-bis(oxidanyl)pentan-3-ylamino]ethyl (Z)-octadec-9-enoate

Systemtic Name: 2-[1,5-bis(oxidanyl)pentan-3-ylamino]ethyl (Z)-octadec-9-enoate Openeye Name: 2-[[3-hydroxy-1-(2-hydroxyethyl)propyl]amino]ethyl (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid 2-(1,5-dihydroxypentan-3-ylamino)ethyl ester IUPAC Name: 2-(1,5-dihydroxypentan-3-ylamino)ethyl (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid 2-[[3-hydroxy-1-(2-hydroxyethyl)propyl]amino]ethyl ester Formula: C25H49NO4 MolecularWeight: 427.66086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCCNC(CCO)CCO

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OCCNC(CCO)CCO

InChI

InChI=1S/C25H49NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(29)30-23-20-26-24(18-21-27)19-22-28/h9-10,24,26-28H,2-8,11-23H2,1H3/b10-9-