1,3-bis[(E)-octadec-9-enoxy]propan-2-yl 4-(ethylamino)butanoate

Systemtic Name: 1,3-bis[(E)-octadec-9-enoxy]propan-2-yl 4-(ethylamino)butanoate Openeye Name: [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] 4-(ethylamino)butanoate CAS Name: 4-(ethylamino)butanoic acid 1,3-bis[(E)-octadec-9-enoxy]propan-2-yl ester IUPAC Name: 1,3-bis[(E)-octadec-9-enoxy]propan-2-yl 4-(ethylamino)butanoate Traditional Name: 4-(ethylamino)butyric acid [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] ester Formula: C45H87NO4 MolecularWeight: 706.17658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COCCCCCCCCC=CCCCCCCCC)OC(=O)CCCNCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(OC(=O)CCCNCC)COCCCCCCCC/C=C/CCCCCCCC

InChI

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