2-methylheptadecan-2-yl(1-pyrrolidin-3-ylpropyl)azanium iodide

Systemtic Name: 2-methylheptadecan-2-yl(1-pyrrolidin-3-ylpropyl)azanium iodide Openeye Name: 1,1-dimethylhexadecyl(1-pyrrolidin-3-ylpropyl)ammonium iodide CAS Name: 2-methylheptadecan-2-yl-[1-(3-pyrrolidinyl)propyl]ammonium iodide IUPAC Name: 2-methylheptadecan-2-yl(1-pyrrolidin-3-ylpropyl)azanium iodide Traditional Name: 1,1-dimethylhexadecyl(1-pyrrolidin-3-ylpropyl)ammonium iodide Formula: C25H53IN2 MolecularWeight: 508.60619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)(C)[NH2+]C(CC)C1CCNC1.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(C)(C)[NH2+]C(CC)C1CCNC1.[I-]

InChI

InChI=1S/C25H52N2.HI/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-25(3,4)27-24(6-2)23-19-21-26-22-23;/h23-24,26-27H,5-22H2,1-4H3;1H