triethyl-(3-methyl-3-oxidanyl-5-phenyl-pent-4-ynyl)azanium iodide

Systemtic Name: triethyl-(3-methyl-3-oxidanyl-5-phenyl-pent-4-ynyl)azanium iodide Openeye Name: triethyl-(3-hydroxy-3-methyl-5-phenyl-pent-4-ynyl)ammonium iodide CAS Name: triethyl-(3-hydroxy-3-methyl-5-phenylpent-4-ynyl)ammonium iodide IUPAC Name: triethyl-(3-hydroxy-3-methyl-5-phenylpent-4-ynyl)azanium iodide Traditional Name: triethyl-(3-hydroxy-3-methyl-5-phenyl-pent-4-ynyl)ammonium iodide Formula: C18H28INO MolecularWeight: 401.32549

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCC(C)(C#CC1=CC=CC=C1)O.[I-]

Isomeric SMILES

CC[N+](CC)(CC)CCC(C)(C#CC1=CC=CC=C1)O.[I-]

InChI

InChI=1S/C18H28NO.HI/c1-5-19(6-2,7-3)16-15-18(4,20)14-13-17-11-9-8-10-12-17;/h8-12,20H,5-7,15-16H2,1-4H3;1H/q+1;/p-1