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

Systemtic Name: 1,3-bis[(E)-octadec-9-enoxy]propan-2-yl 4-pyrrolidin-1-ylbutanoate Openeye Name: [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] 4-pyrrolidin-1-ylbutanoate CAS Name: 4-(1-pyrrolidinyl)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-pyrrolidin-1-ylbutanoate Traditional Name: 4-pyrrolidinobutyric acid [2-[(E)-octadec-9-enoxy]-1-[[(E)-octadec-9-enoxy]methyl]ethyl] ester Formula: C47H89NO4 MolecularWeight: 732.21386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COCCCCCCCCC=CCCCCCCCC)OC(=O)CCCN1CCCC1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(OC(=O)CCCN1CCCC1)COCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C47H89NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-42-50-44-46(52-47(49)38-37-41-48-39-33-34-40-48)45-51-43-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,46H,3-16,21-45H2,1-2H3/b19-17+,20-18+