N-(4-methyl-2-nitro-phenyl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: N-(4-methyl-2-nitro-phenyl)quinuclidin-3-amine CAS Name: N-(4-methyl-2-nitrophenyl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: N-(4-methyl-2-nitrophenyl)-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: (4-methyl-2-nitro-phenyl)-quinuclidin-3-yl-amine Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2CN3CCC2CC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC2CN3CCC2CC3)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O2/c1-10-2-3-12(14(8-10)17(18)19)15-13-9-16-6-4-11(13)5-7-16/h2-3,8,11,13,15H,4-7,9H2,1H3