3-[(2-chlorophenyl)methyl]-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide Openeye Name: 3-[(2-chlorophenyl)methyl]-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide CAS Name: 3-[(2-chlorophenyl)methyl]-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide IUPAC Name: 3-[(2-chlorophenyl)methyl]-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide Traditional Name: 3-(2-chlorobenzyl)-3,8,8-trimethyl-3-azoniabicyclo[3.2.1]octane iodide Formula: C17H25ClIN MolecularWeight: 405.74457

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1C[N+](C2)(C)CC3=CC=CC=C3Cl)C.[I-]

Isomeric SMILES

CC1(C2CCC1C[N+](C2)(C)CC3=CC=CC=C3Cl)C.[I-]

InChI

InChI=1S/C17H25ClN.HI/c1-17(2)14-8-9-15(17)12-19(3,11-14)10-13-6-4-5-7-16(13)18;/h4-7,14-15H,8-12H2,1-3H3;1H/q+1;/p-1