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

Systemtic Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dimethylamino)butanoate Openeye Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dimethylamino)butanoate CAS Name: 4-(dimethylamino)butanoic acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester IUPAC Name: 2,3-bis[(E)-octadec-9-enoxy]propyl 4-(dimethylamino)butanoate Traditional Name: 4-(dimethylamino)butyric acid 2,3-bis[(E)-octadec-9-enoxy]propyl ester Formula: C45H87NO4 MolecularWeight: 706.17658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C45H87NO4/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40-48-42-44(43-50-45(47)38-37-39-46(3)4)49-41-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22,44H,5-18,23-43H2,1-4H3/b21-19+,22-20+