2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide

Systemtic Name: 2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide Openeye Name: 2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide CAS Name: 2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide IUPAC Name: 2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide Traditional Name: 2,2-dimethyl-1,3,4,5,6,7-hexahydro-2-benzazonin-2-ium iodide Formula: C14H22IN MolecularWeight: 331.23565

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCCC2=CC=CC=C2C1)C.[I-]

Isomeric SMILES

C[N+]1(CCCCCC2=CC=CC=C2C1)C.[I-]

InChI

InChI=1S/C14H22N.HI/c1-15(2)11-7-3-4-8-13-9-5-6-10-14(13)12-15;/h5-6,9-10H,3-4,7-8,11-12H2,1-2H3;1H/q+1;/p-1