[4-(4-fluorophenyl)piperazin-4-ium-1-yl]-(3-nitrophenyl)methanone chloride

Systemtic Name: [4-(4-fluorophenyl)piperazin-4-ium-1-yl]-(3-nitrophenyl)methanone chloride Openeye Name: [4-(4-fluorophenyl)piperazin-4-ium-1-yl]-(3-nitrophenyl)methanone chloride CAS Name: [4-(4-fluorophenyl)-1-piperazin-4-iumyl]-(3-nitrophenyl)methanone chloride IUPAC Name: [4-(4-fluorophenyl)piperazin-4-ium-1-yl]-(3-nitrophenyl)methanone chloride Traditional Name: [4-(4-fluorophenyl)piperazin-4-ium-1-yl]-(3-nitrophenyl)methanone chloride Formula: C17H17ClFN3O3 MolecularWeight: 365.786583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C17H16FN3O3.ClH/c18-14-4-6-15(7-5-14)19-8-10-20(11-9-19)17(22)13-2-1-3-16(12-13)21(23)24;/h1-7,12H,8-11H2;1H