4-[(5-bromanyl-2-ethoxy-phenyl)methyl]-4-methyl-morpholin-4-ium iodide

Systemtic Name: 4-[(5-bromanyl-2-ethoxy-phenyl)methyl]-4-methyl-morpholin-4-ium iodide Openeye Name: 4-[(5-bromo-2-ethoxy-phenyl)methyl]-4-methyl-morpholin-4-ium iodide CAS Name: 4-[(5-bromo-2-ethoxyphenyl)methyl]-4-methylmorpholin-4-ium iodide IUPAC Name: 4-[(5-bromo-2-ethoxyphenyl)methyl]-4-methylmorpholin-4-ium iodide Traditional Name: 4-(5-bromo-2-ethoxy-benzyl)-4-methyl-morpholin-4-ium iodide Formula: C14H21BrINO2 MolecularWeight: 442.13051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C[N+]2(CCOCC2)C.[I-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C[N+]2(CCOCC2)C.[I-]

InChI

InChI=1S/C14H21BrNO2.HI/c1-3-18-14-5-4-13(15)10-12(14)11-16(2)6-8-17-9-7-16;/h4-5,10H,3,6-9,11H2,1-2H3;1H/q+1;/p-1