(6-cyano-3-ethyl-6,6-diphenyl-hexan-3-yl)azanium iodide

Systemtic Name: (6-cyano-3-ethyl-6,6-diphenyl-hexan-3-yl)azanium iodide Openeye Name: (4-cyano-1,1-diethyl-4,4-diphenyl-butyl)ammonium iodide CAS Name: (6-cyano-3-ethyl-6,6-diphenylhexan-3-yl)ammonium iodide IUPAC Name: (6-cyano-3-ethyl-6,6-diphenylhexan-3-yl)azanium iodide Traditional Name: (4-cyano-1,1-diethyl-4,4-diphenyl-butyl)ammonium iodide Formula: C21H27IN2 MolecularWeight: 434.35695

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)[NH3+].[I-]

Isomeric SMILES

CCC(CC)(CCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)[NH3+].[I-]

InChI

InChI=1S/C21H26N2.HI/c1-3-20(23,4-2)15-16-21(17-22,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14H,3-4,15-16,23H2,1-2H3;1H