(3R)-N-(4-chloranyl-2-nitro-phenyl)-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3R)-N-(4-chloranyl-2-nitro-phenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3R)-N-(4-chloro-2-nitro-phenyl)quinuclidin-1-ium-3-amine CAS Name: (3R)-N-(4-chloro-2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3R)-N-(4-chloro-2-nitrophenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: (4-chloro-2-nitro-phenyl)-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C13H17ClN3O2+ MolecularWeight: 282.74598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3O2/c14-10-1-2-11(13(7-10)17(18)19)15-12-8-16-5-3-9(12)4-6-16/h1-2,7,9,12,15H,3-6,8H2/p+1/t12-/m0/s1