6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-amine

Systemtic Name: 6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-amine Openeye Name: 6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-amine CAS Name: 6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-amine IUPAC Name: 6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-amine Traditional Name: [6-(2-methyl-1H-imidazol-3-ium-3-yl)-2,3-dihydro-1,4-benzodioxin-7-yl]amine Formula: C12H14N3O2+ MolecularWeight: 232.25846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)C2=CC3=C(C=C2N)OCCO3

Isomeric SMILES

CC1=[N+](C=CN1)C2=CC3=C(C=C2N)OCCO3

InChI

InChI=1S/C12H13N3O2/c1-8-14-2-3-15(8)10-7-12-11(6-9(10)13)16-4-5-17-12/h2-3,6-7H,4-5,13H2,1H3/p+1