(3R)-N-(2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3R)-N-(2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3R)-N-(2-nitrophenyl)quinuclidin-1-ium-3-amine CAS Name: (3R)-N-(2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3R)-N-(2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: (2-nitrophenyl)-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O2/c17-16(18)13-4-2-1-3-11(13)14-12-9-15-7-5-10(12)6-8-15/h1-4,10,12,14H,5-9H2/p+1/t12-/m0/s1