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4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-pentanenitrile iodide

4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-pentanenitrile iodide

Systemtic Name:4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-pentanenitrile iodide
Openeye Name:4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-pentanenitrile iodide
CAS Name:4-(1-methyl-1-piperidin-1-iumyl)-2,2-diphenylpentanenitrile iodide
IUPAC Name:4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenylpentanenitrile iodide
Traditional Name:4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenyl-valeronitrile iodide
Formula: C23H29IN2
MolecularWeight: 460.39423
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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)[N+]3(CCCCC3)C.[I-]


Isomeric SMILES

CC(CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)[N+]3(CCCCC3)C.[I-]


InChI

InChI=1S/C23H29N2.HI/c1-20(25(2)16-10-5-11-17-25)18-23(19-24,21-12-6-3-7-13-21)22-14-8-4-9-15-22;/h3-4,6-9,12-15,20H,5,10-11,16-18H2,1-2H3;1H/q+1;/p-1


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