[2-chloranyl-4,5-bis(fluoranyl)phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-chloranyl-4,5-bis(fluoranyl)phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (2-chloro-4,5-difluoro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (2-chloro-4,5-difluorophenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2-chloro-4,5-difluorophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (2-chloro-4,5-difluoro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C12H14ClF2N2O+ MolecularWeight: 275.702166

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2Cl)F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2Cl)F)F

InChI

InChI=1S/C12H13ClF2N2O/c1-16-2-4-17(5-3-16)12(18)8-6-10(14)11(15)7-9(8)13/h6-7H,2-5H2,1H3/p+1