1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide

Systemtic Name: 1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide Openeye Name: 1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide CAS Name: 1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide IUPAC Name: 1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide Traditional Name: 1-[3-(bromomethyl)-1-adamantyl]pyridin-1-ium bromide Formula: C16H21Br2N MolecularWeight: 387.15264

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)[N+]4=CC=CC=C4)CBr.[Br-]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)[N+]4=CC=CC=C4)CBr.[Br-]

InChI

InChI=1S/C16H21BrN.BrH/c17-12-15-7-13-6-14(8-15)10-16(9-13,11-15)18-4-2-1-3-5-18;/h1-5,13-14H,6-12H2;1H/q+1;/p-1