2-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(3-nitro-2-pyridyl)-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-(3-nitro-2-pyridinyl)-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(3-nitro-2-pyridyl)-4-piperidyl]-1H-benzimidazole Formula: C17H17N5O2 MolecularWeight: 323.34918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3N2)C4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3N2)C4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O2/c23-22(24)15-6-3-9-18-17(15)21-10-7-12(8-11-21)16-19-13-4-1-2-5-14(13)20-16/h1-6,9,12H,7-8,10-11H2,(H,19,20)