1-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]benzimidazol-2-one

Systemtic Name: 1-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]benzimidazol-2-one Openeye Name: 1-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxo-propyl]benzimidazol-2-one CAS Name: 1-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-oxopropyl]-2-benzimidazolone IUPAC Name: 1-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxopropyl]benzimidazol-2-one Traditional Name: 1-[3-keto-3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propyl]-3-methyl-benzimidazol-2-one Formula: C22H22F3N5O4 MolecularWeight: 477.43639

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H22F3N5O4/c1-26-16-4-2-3-5-18(16)29(21(26)32)9-8-20(31)28-12-10-27(11-13-28)17-7-6-15(22(23,24)25)14-19(17)30(33)34/h2-7,14H,8-13H2,1H3