N-(1-azabicyclo[2.2.2]octan-3-yl)-5-nitro-quinoline-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-nitro-quinoline-2-carboxamide Openeye Name: 5-nitro-N-quinuclidin-3-yl-quinoline-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-nitro-2-quinolinecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-nitroquinoline-2-carboxamide Traditional Name: 5-nitro-N-quinuclidin-3-yl-quinaldamide Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=NC4=C(C=C3)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=NC4=C(C=C3)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3/c22-17(19-15-10-20-8-6-11(15)7-9-20)14-5-4-12-13(18-14)2-1-3-16(12)21(23)24/h1-5,11,15H,6-10H2,(H,19,22)