2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dipropylamino)butanoate

Systemtic Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dipropylamino)butanoate Openeye Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dipropylamino)butanoate CAS Name: 4-(dipropylamino)butanoic acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester IUPAC Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dipropylamino)butanoate Traditional Name: 4-(dipropylamino)butyric acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester Formula: C49H95NO4 MolecularWeight: 762.2829

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COC(=O)CCCN(CCC)CCC)OCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(COC(=O)CCCN(CCC)CCC)OCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C49H95NO4/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44-52-46-48(47-54-49(51)40-39-43-50(41-7-3)42-8-4)53-45-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h21-24,48H,5-20,25-47H2,1-4H3/b23-21+,24-22+