butyl 3-[(4-nitro-1-oxidanidyl-pyridin-1-ium-3-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: butyl 3-[(4-nitro-1-oxidanidyl-pyridin-1-ium-3-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: butyl 3-[(4-nitro-1-oxido-pyridin-1-ium-3-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-[(4-nitro-1-oxido-3-pyridin-1-iumyl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylic acid butyl ester IUPAC Name: butyl 3-[(4-nitro-1-oxidopyridin-1-ium-3-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-[(4-nitro-1-oxido-pyridin-1-ium-3-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylic acid butyl ester Formula: C17H24N4O5 MolecularWeight: 364.39626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C2CCC1CC(C2)NC3=C(C=C[N+](=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)N1C2CCC1CC(C2)NC3=C(C=C[N+](=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O5/c1-2-3-8-26-17(22)20-13-4-5-14(20)10-12(9-13)18-15-11-19(23)7-6-16(15)21(24)25/h6-7,11-14,18H,2-5,8-10H2,1H3