1-[3-(iodanylmethyl)-1-adamantyl]quinolin-1-ium iodide

Systemtic Name: 1-[3-(iodanylmethyl)-1-adamantyl]quinolin-1-ium iodide Openeye Name: 1-[3-(iodomethyl)-1-adamantyl]quinolin-1-ium iodide CAS Name: 1-[3-(iodomethyl)-1-adamantyl]quinolin-1-ium iodide IUPAC Name: 1-[3-(iodomethyl)-1-adamantyl]quinolin-1-ium iodide Traditional Name: 1-[3-(iodomethyl)-1-adamantyl]quinolin-1-ium iodide Formula: C20H23I2N MolecularWeight: 531.21226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)[N+]4=CC=CC5=CC=CC=C54)CI.[I-]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)[N+]4=CC=CC5=CC=CC=C54)CI.[I-]

InChI

InChI=1S/C20H23IN.HI/c21-14-19-9-15-8-16(10-19)12-20(11-15,13-19)22-7-3-5-17-4-1-2-6-18(17)22;/h1-7,15-16H,8-14H2;1H/q+1;/p-1