[3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-diethyl-methyl-azanium iodide

Systemtic Name: [3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-diethyl-methyl-azanium iodide Openeye Name: [3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-diethyl-methyl-ammonium iodide CAS Name: [3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-diethyl-methylammonium iodide IUPAC Name: [3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-diethyl-methylazanium iodide Traditional Name: [3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-diethyl-methyl-ammonium iodide Formula: C24H38INO2 MolecularWeight: 499.46849

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC(COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O.[I-]

Isomeric SMILES

CC[N+](C)(CC)CC(COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O.[I-]

InChI

InChI=1S/C24H38NO2.HI/c1-4-25(3,5-2)16-22(26)17-27-23-8-6-21(7-9-23)24-13-18-10-19(14-24)12-20(11-18)15-24;/h6-9,18-20,22,26H,4-5,10-17H2,1-3H3;1H/q+1;/p-1