2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium iodide

Systemtic Name: 2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium iodide Openeye Name: 2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium iodide CAS Name: 2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium iodide IUPAC Name: 2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium iodide Traditional Name: 2,2-dimethyl-1,3,9,9a-tetrahydrobenz[f]isoindol-2-ium iodide Formula: C14H18IN MolecularWeight: 327.20389

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2CC3=CC=CC=C3C=C2C1)C.[I-]

Isomeric SMILES

C[N+]1(CC2CC3=CC=CC=C3C=C2C1)C.[I-]

InChI

InChI=1S/C14H18N.HI/c1-15(2)9-13-7-11-5-3-4-6-12(11)8-14(13)10-15;/h3-7,14H,8-10H2,1-2H3;1H/q+1;/p-1