(4,4-diethylcyclohexyl)benzene; 8-iodanyl-8-azabicyclo[2.2.2]octa-1,3,5-triene

Systemtic Name: (4,4-diethylcyclohexyl)benzene; 8-iodanyl-8-azabicyclo[2.2.2]octa-1,3,5-triene Openeye Name: (4,4-diethylcyclohexyl)benzene; 8-iodo-8-azabicyclo[2.2.2]octa-1,3,5-triene CAS Name: (4,4-diethylcyclohexyl)benzene; 8-iodo-8-azabicyclo[2.2.2]octa-1,3,5-triene IUPAC Name: (4,4-diethylcyclohexyl)benzene; 8-iodo-8-azabicyclo[2.2.2]octa-1,3,5-triene Traditional Name: (4,4-diethylcyclohexyl)benzene; 8-iodo-8-azabicyclo[2.2.2]octa-1,3,5-triene Formula: C23H30IN MolecularWeight: 447.39547

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(CC1)C2=CC=CC=C2)CC.C1C2=CC=C(N1I)C=C2

Isomeric SMILES

CCC1(CCC(CC1)C2=CC=CC=C2)CC.C1C2=CC=C(N1I)C=C2

InChI

InChI=1S/C16H24.C7H6IN/c1-3-16(4-2)12-10-15(11-13-16)14-8-6-5-7-9-14;8-9-5-6-1-3-7(9)4-2-6/h5-9,15H,3-4,10-13H2,1-2H3;1-4H,5H2