N-(6-nitro-1,3-benzodioxol-5-yl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: N-(6-nitro-1,3-benzodioxol-5-yl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: N-(6-nitro-1,3-benzodioxol-5-yl)quinuclidin-3-amine CAS Name: N-(6-nitro-1,3-benzodioxol-5-yl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: N-(6-nitro-1,3-benzodioxol-5-yl)-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: (6-nitro-1,3-benzodioxol-5-yl)-quinuclidin-3-yl-amine Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

C1CN2CCC1C(C2)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C14H17N3O4/c18-17(19)12-6-14-13(20-8-21-14)5-10(12)15-11-7-16-3-1-9(11)2-4-16/h5-6,9,11,15H,1-4,7-8H2