5-chloranyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione bromide

Systemtic Name: 5-chloranyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione bromide Openeye Name: 5-chloro-2-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione bromide CAS Name: 5-chloro-2-[2-(4-methyl-4-morpholin-4-iumyl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione bromide IUPAC Name: 5-chloro-2-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione bromide Traditional Name: 5-chloro-2-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone bromide Formula: C15H22BrClN2O3 MolecularWeight: 393.70378

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCN2C(=O)C3CC=C(CC3C2=O)Cl.[Br-]

Isomeric SMILES

C[N+]1(CCOCC1)CCN2C(=O)C3CC=C(CC3C2=O)Cl.[Br-]

InChI

InChI=1S/C15H22ClN2O3.BrH/c1-18(6-8-21-9-7-18)5-4-17-14(19)12-3-2-11(16)10-13(12)15(17)20;/h2,12-13H,3-10H2,1H3;1H/q+1;/p-1