2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C15H21N4O4+ MolecularWeight: 321.35164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[N+]23CCN(CC2)CC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[N+]23CCN(CC2)CC3

InChI

InChI=1S/C15H20N4O4/c1-23-14-10-12(18(21)22)2-3-13(14)16-15(20)11-19-7-4-17(5-8-19)6-9-19/h2-3,10H,4-9,11H2,1H3/p+1