2-(3-morpholin-4-ylpropyl)-3H-isoindol-2-ium-1-amine bromide

Systemtic Name: 2-(3-morpholin-4-ylpropyl)-3H-isoindol-2-ium-1-amine bromide Openeye Name: 2-(3-morpholinopropyl)-3H-isoindol-2-ium-1-amine bromide CAS Name: 2-[3-(4-morpholinyl)propyl]-3H-isoindol-2-ium-1-amine bromide IUPAC Name: 2-(3-morpholin-4-ylpropyl)-3H-isoindol-2-ium-1-amine bromide Traditional Name: [2-(3-morpholinopropyl)-3H-isoindol-2-ium-1-yl]amine bromide Formula: C15H22BrN3O MolecularWeight: 340.25868

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC[N+]2=C(C3=CC=CC=C3C2)N.[Br-]

Isomeric SMILES

C1COCCN1CCC[N+]2=C(C3=CC=CC=C3C2)N.[Br-]

InChI

InChI=1S/C15H21N3O.BrH/c16-15-14-5-2-1-4-13(14)12-18(15)7-3-6-17-8-10-19-11-9-17;/h1-2,4-5,16H,3,6-12H2;1H