4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-nitro-benzamide

Systemtic Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-nitro-benzamide Openeye Name: 3-nitro-4-(quinuclidin-3-ylamino)benzamide CAS Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-nitrobenzamide IUPAC Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-nitrobenzamide Traditional Name: 3-nitro-4-(quinuclidin-3-ylamino)benzamide Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O3/c15-14(19)10-1-2-11(13(7-10)18(20)21)16-12-8-17-5-3-9(12)4-6-17/h1-2,7,9,12,16H,3-6,8H2,(H2,15,19)