2-[1-(3-methyl-5-nitro-imidazol-4-yl)piperidin-3-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(3-methyl-5-nitro-imidazol-4-yl)piperidin-3-yl]-1H-benzimidazole Openeye Name: 2-[1-(3-methyl-5-nitro-imidazol-4-yl)-3-piperidyl]-1H-benzimidazole CAS Name: 2-[1-(3-methyl-5-nitro-4-imidazolyl)-3-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(3-methyl-5-nitroimidazol-4-yl)piperidin-3-yl]-1H-benzimidazole Traditional Name: 2-[1-(3-methyl-5-nitro-imidazol-4-yl)-3-piperidyl]-1H-benzimidazole Formula: C16H18N6O2 MolecularWeight: 326.35312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2CCCC(C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2CCCC(C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O2/c1-20-10-17-15(22(23)24)16(20)21-8-4-5-11(9-21)14-18-12-6-2-3-7-13(12)19-14/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H,18,19)