2-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(3-nitrophenyl)sulfonyl-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-(3-nitrophenyl)sulfonyl-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(3-nitrophenyl)sulfonyl-4-piperidyl]-1H-benzimidazole Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4S/c23-22(24)14-4-3-5-15(12-14)27(25,26)21-10-8-13(9-11-21)18-19-16-6-1-2-7-17(16)20-18/h1-7,12-13H,8-11H2,(H,19,20)