2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]-1-piperazinyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-[2-(dimethylamino)-5-nitrobenzoyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazino]-N-(4-fluorophenyl)acetamide Formula: C21H24FN5O4 MolecularWeight: 429.444763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN5O4/c1-24(2)19-8-7-17(27(30)31)13-18(19)21(29)26-11-9-25(10-12-26)14-20(28)23-16-5-3-15(22)4-6-16/h3-8,13H,9-12,14H2,1-2H3,(H,23,28)