4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-oxidanyl-benzeneamine oxide Openeye Name: 4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-hydroxy-benzeneamine oxide CAS Name: 4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-hydroxybenzeneamine oxide IUPAC Name: 4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-hydroxybenzeneamine oxide Traditional Name: 4-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)-N-hydroxy-benzeneamine oxide Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN1CC2)CC3=CC=C(C=C3)[NH+](O)[O-]

Isomeric SMILES

C1C[N+]2(CCN1CC2)CC3=CC=C(C=C3)[NH+](O)[O-]

InChI

InChI=1S/C13H20N3O2/c17-15(18)13-3-1-12(2-4-13)11-16-8-5-14(6-9-16)7-10-16/h1-4,15,17H,5-11H2/q+1