tert-butyl-(5-cyano-1H-indol-3-yl)azanium iodide

Systemtic Name: tert-butyl-(5-cyano-1H-indol-3-yl)azanium iodide Openeye Name: tert-butyl-(5-cyano-1H-indol-3-yl)ammonium iodide CAS Name: tert-butyl-(5-cyano-1H-indol-3-yl)ammonium iodide IUPAC Name: tert-butyl-(5-cyano-1H-indol-3-yl)azanium iodide Traditional Name: tert-butyl-(5-cyano-1H-indol-3-yl)ammonium iodide Formula: C13H16IN3 MolecularWeight: 341.19071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]C1=CNC2=C1C=C(C=C2)C#N.[I-]

Isomeric SMILES

CC(C)(C)[NH2+]C1=CNC2=C1C=C(C=C2)C#N.[I-]

InChI

InChI=1S/C13H15N3.HI/c1-13(2,3)16-12-8-15-11-5-4-9(7-14)6-10(11)12;/h4-6,8,15-16H,1-3H3;1H