(2,4-dichlorophenyl)-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2,4-dichlorophenyl)-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone Openeye Name: (2,4-dichlorophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone CAS Name: (2,4-dichlorophenyl)-[4-[4-fluoro-2-nitro-5-(1-pyrrolidinyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2,4-dichlorophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone Traditional Name: (2,4-dichlorophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidino-phenyl)piperazino]methanone Formula: C21H21Cl2FN4O3 MolecularWeight: 467.320843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-])F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-])F

InChI

InChI=1S/C21H21Cl2FN4O3/c22-14-3-4-15(16(23)11-14)21(29)27-9-7-26(8-10-27)19-13-18(25-5-1-2-6-25)17(24)12-20(19)28(30)31/h3-4,11-13H,1-2,5-10H2