2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-amine

Systemtic Name: 2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-amine Openeye Name: 2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-amine CAS Name: 2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-amine IUPAC Name: 2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-amine Traditional Name: (2,2-dimethyl-4H-1,3,2-benzodioxazin-2-ium-5-yl)amine Formula: C9H13N2O2+ MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(OCC2=C(C=CC=C2O1)N)C

Isomeric SMILES

C[N+]1(OCC2=C(C=CC=C2O1)N)C

InChI

InChI=1S/C9H13N2O2/c1-11(2)12-6-7-8(10)4-3-5-9(7)13-11/h3-5H,6,10H2,1-2H3/q+1