3-nitro-N-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide

Systemtic Name: 3-nitro-N-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide Openeye Name: 3-nitro-N-[9-(2-thienylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide CAS Name: 3-nitro-N-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide IUPAC Name: 3-nitro-N-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide Traditional Name: 3-nitro-N-[9-(2-thenyl)-9-azabicyclo[3.3.1]nonan-3-yl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)N2CC3=CC=CS3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2CC(CC(C1)N2CC3=CC=CS3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3S/c24-20(14-4-1-7-18(10-14)23(25)26)21-15-11-16-5-2-6-17(12-15)22(16)13-19-8-3-9-27-19/h1,3-4,7-10,15-17H,2,5-6,11-13H2,(H,21,24)