8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinolin-8-ium iodide

Systemtic Name: 8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinolin-8-ium iodide Openeye Name: 8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinolin-8-ium iodide CAS Name: 8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinolin-8-ium iodide IUPAC Name: 8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinolin-8-ium iodide Traditional Name: 8-lauryl-1-methyl-2,3,3a,4,5,9b-hexahydropyrrol[3,2-h]isoquinolin-8-ium iodide Formula: C24H41IN2 MolecularWeight: 484.50021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC2=C(CCC3C2N(CC3)C)C=C1.[I-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC2=C(CCC3C2N(CC3)C)C=C1.[I-]

InChI

InChI=1S/C24H41N2.HI/c1-3-4-5-6-7-8-9-10-11-12-17-26-19-16-21-13-14-22-15-18-25(2)24(22)23(21)20-26;/h16,19-20,22,24H,3-15,17-18H2,1-2H3;1H/q+1;/p-1