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

Systemtic Name: 1,3-bis[(E)-octadec-9-enoxy]propan-2-yl 4-[ethyl(methyl)amino]butanoate Openeye Name: [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] 4-[ethyl(methyl)amino]butanoate CAS Name: 4-[ethyl(methyl)amino]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-[ethyl(methyl)amino]butanoate Traditional Name: 4-[ethyl(methyl)amino]butyric acid [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] ester Formula: C46H89NO4 MolecularWeight: 720.20316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COCCCCCCCCC=CCCCCCCCC)OC(=O)CCCN(C)CC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(OC(=O)CCCN(CC)C)COCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C46H89NO4/c1-5-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41-49-43-45(51-46(48)39-38-40-47(4)7-3)44-50-42-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-6-2/h20-23,45H,5-19,24-44H2,1-4H3/b22-20+,23-21+