1-(3-iodanylprop-2-ynyl)-3-methyl-1-octadecyl-pyrrolidin-1-ium

Systemtic Name: 1-(3-iodanylprop-2-ynyl)-3-methyl-1-octadecyl-pyrrolidin-1-ium Openeye Name: 1-(3-iodoprop-2-ynyl)-3-methyl-1-octadecyl-pyrrolidin-1-ium CAS Name: 1-(3-iodoprop-2-ynyl)-3-methyl-1-octadecylpyrrolidin-1-ium IUPAC Name: 1-(3-iodoprop-2-ynyl)-3-methyl-1-octadecylpyrrolidin-1-ium Traditional Name: 1-(3-iodoprop-2-ynyl)-3-methyl-1-stearyl-pyrrolidin-1-ium Formula: C26H49IN+ MolecularWeight: 502.57843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1(CCC(C1)C)CC#CI

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1(CCC(C1)C)CC#CI

InChI

InChI=1S/C26H49IN/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28(23-19-21-27)24-20-26(2)25-28/h26H,3-18,20,22-25H2,1-2H3/q+1