trimethyl-[2-[4-(phenylmethyl)phthalazin-1-yl]oxyethyl]azanium iodide

Systemtic Name: trimethyl-[2-[4-(phenylmethyl)phthalazin-1-yl]oxyethyl]azanium iodide Openeye Name: 2-(4-benzylphthalazin-1-yl)oxyethyl-trimethyl-ammonium iodide CAS Name: trimethyl-[2-[[4-(phenylmethyl)-1-phthalazinyl]oxy]ethyl]ammonium iodide IUPAC Name: 2-(4-benzylphthalazin-1-yl)oxyethyl-trimethylazanium iodide Traditional Name: 2-(4-benzylphthalazin-1-yl)oxyethyl-trimethyl-ammonium iodide Formula: C20H24IN3O MolecularWeight: 449.32853

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC1=NN=C(C2=CC=CC=C21)CC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+](C)(C)CCOC1=NN=C(C2=CC=CC=C21)CC3=CC=CC=C3.[I-]

InChI

InChI=1S/C20H24N3O.HI/c1-23(2,3)13-14-24-20-18-12-8-7-11-17(18)19(21-22-20)15-16-9-5-4-6-10-16;/h4-12H,13-15H2,1-3H3;1H/q+1;/p-1