1-phenethyl-4-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane iodide

Systemtic Name: 1-phenethyl-4-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane iodide Openeye Name: 4-benzyl-1-phenethyl-1-azoniabicyclo[2.2.1]heptane iodide CAS Name: 1-phenethyl-4-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane iodide IUPAC Name: 4-benzyl-1-phenethyl-1-azoniabicyclo[2.2.1]heptane iodide Traditional Name: 4-benzyl-1-phenethyl-1-azoniabicyclo[2.2.1]heptane iodide Formula: C21H26IN MolecularWeight: 419.34231

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1(C2)CC3=CC=CC=C3)CCC4=CC=CC=C4.[I-]

Isomeric SMILES

C1C[N+]2(CCC1(C2)CC3=CC=CC=C3)CCC4=CC=CC=C4.[I-]

InChI

InChI=1S/C21H26N.HI/c1-3-7-19(8-4-1)11-14-22-15-12-21(18-22,13-16-22)17-20-9-5-2-6-10-20;/h1-10H,11-18H2;1H/q+1;/p-1