bis(3-hexadecoxypropyl)-[(2,3,4-tributyl-5-oxidanylidene-pyrrolidin-1-yl)methyl]azanium

Systemtic Name: bis(3-hexadecoxypropyl)-[(2,3,4-tributyl-5-oxidanylidene-pyrrolidin-1-yl)methyl]azanium Openeye Name: bis(3-hexadecoxypropyl)-[(2,3,4-tributyl-5-oxo-pyrrolidin-1-yl)methyl]ammonium CAS Name: bis(3-hexadecoxypropyl)-[(2,3,4-tributyl-5-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: bis(3-hexadecoxypropyl)-[(2,3,4-tributyl-5-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: bis(3-cetyloxypropyl)-[(2,3,4-tributyl-5-keto-pyrrolidino)methyl]ammonium Formula: C55H111N2O3+ MolecularWeight: 848.48144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCC[NH+](CCCOCCCCCCCCCCCCCCCC)CN1C(C(C(C1=O)CCCC)CCCC)CCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCC[NH+](CCCOCCCCCCCCCCCCCCCC)CN1C(C(C(C1=O)CCCC)CCCC)CCCC

InChI

InChI=1S/C55H110N2O3/c1-6-11-16-18-20-22-24-26-28-30-32-34-36-38-47-59-49-40-45-56(46-41-50-60-48-39-37-35-33-31-29-27-25-23-21-19-17-12-7-2)51-57-54(44-15-10-5)52(42-13-8-3)53(55(57)58)43-14-9-4/h52-54H,6-51H2,1-5H3/p+1