1-(5,5-diphenylpent-2-ynyl)-1-methyl-piperidin-1-ium iodide

Systemtic Name: 1-(5,5-diphenylpent-2-ynyl)-1-methyl-piperidin-1-ium iodide Openeye Name: 1-(5,5-diphenylpent-2-ynyl)-1-methyl-piperidin-1-ium iodide CAS Name: 1-(5,5-diphenylpent-2-ynyl)-1-methylpiperidin-1-ium iodide IUPAC Name: 1-(5,5-diphenylpent-2-ynyl)-1-methylpiperidin-1-ium iodide Traditional Name: 1-(5,5-diphenylpent-2-ynyl)-1-methyl-piperidin-1-ium iodide Formula: C23H28IN MolecularWeight: 445.37959

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC#CCC(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)CC#CCC(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C23H28N.HI/c1-24(18-10-4-11-19-24)20-12-9-17-23(21-13-5-2-6-14-21)22-15-7-3-8-16-22;/h2-3,5-8,13-16,23H,4,10-11,17-20H2,1H3;1H/q+1;/p-1