2-[4-(4-methylmorpholin-4-ium-4-yl)butyl]isoindole-1,3-dione iodide

Systemtic Name: 2-[4-(4-methylmorpholin-4-ium-4-yl)butyl]isoindole-1,3-dione iodide Openeye Name: 2-[4-(4-methylmorpholin-4-ium-4-yl)butyl]isoindoline-1,3-dione iodide CAS Name: 2-[4-(4-methyl-4-morpholin-4-iumyl)butyl]isoindole-1,3-dione iodide IUPAC Name: 2-[4-(4-methylmorpholin-4-ium-4-yl)butyl]isoindole-1,3-dione iodide Traditional Name: 2-[4-(4-methylmorpholin-4-ium-4-yl)butyl]isoindoline-1,3-quinone iodide Formula: C17H23IN2O3 MolecularWeight: 430.28059

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCCCN2C(=O)C3=CC=CC=C3C2=O.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCCCN2C(=O)C3=CC=CC=C3C2=O.[I-]

InChI

InChI=1S/C17H23N2O3.HI/c1-19(10-12-22-13-11-19)9-5-4-8-18-16(20)14-6-2-3-7-15(14)17(18)21;/h2-3,6-7H,4-5,8-13H2,1H3;1H/q+1;/p-1