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2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide

2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide

Systemtic Name:2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide
Openeye Name:2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide
CAS Name:2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide
IUPAC Name:2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide
Traditional Name:2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one iodide
Formula: C17H22INO
MolecularWeight: 383.26715
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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=O)CC(C2C1)C3=CC=CC=C3)C.[I-]


Isomeric SMILES

C[N+]1(CCC2=CC(=O)CC(C2C1)C3=CC=CC=C3)C.[I-]


InChI

InChI=1S/C17H22NO.HI/c1-18(2)9-8-14-10-15(19)11-16(17(14)12-18)13-6-4-3-5-7-13;/h3-7,10,16-17H,8-9,11-12H2,1-2H3;1H/q+1;/p-1


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