3-[1-(3-nitro-4-oxidanylidene-4-phenyl-butyl)piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-(3-nitro-4-oxidanylidene-4-phenyl-butyl)piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-(3-nitro-4-oxo-4-phenyl-butyl)-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-(3-nitro-4-oxo-4-phenylbutyl)-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-(3-nitro-4-oxo-4-phenylbutyl)piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-(4-keto-3-nitro-4-phenyl-butyl)-4-piperidyl]-1H-benzimidazol-2-one Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCC(C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCC(C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c27-21(16-6-2-1-3-7-16)20(26(29)30)12-15-24-13-10-17(11-14-24)25-19-9-5-4-8-18(19)23-22(25)28/h1-9,17,20H,10-15H2,(H,23,28)