spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide

Systemtic Name: spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide Openeye Name: spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide CAS Name: spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide IUPAC Name: spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide Traditional Name: spiro[1,3,3a,4-tetrahydroisoindol-2-ium-2,4'-1,4-oxazinan-4-ium] bromide Formula: C12H18BrNO MolecularWeight: 272.18142

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]12CC3CC=CC=C3C2.[Br-]

Isomeric SMILES

C1COCC[N+]12CC3CC=CC=C3C2.[Br-]

InChI

InChI=1S/C12H18NO.BrH/c1-2-4-12-10-13(9-11(12)3-1)5-7-14-8-6-13;/h1-3,12H,4-10H2;1H/q+1;/p-1