[2-chloranyl-5,6-bis(fluoranyl)-3-methyl-phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-chloranyl-5,6-bis(fluoranyl)-3-methyl-phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (2-chloro-5,6-difluoro-3-methyl-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (2-chloro-5,6-difluoro-3-methylphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2-chloro-5,6-difluoro-3-methylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (2-chloro-5,6-difluoro-3-methyl-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C13H16ClF2N2O+ MolecularWeight: 289.728746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C(=O)N2CC[NH+](CC2)C)F)F

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C(=O)N2CC[NH+](CC2)C)F)F

InChI

InChI=1S/C13H15ClF2N2O/c1-8-7-9(15)12(16)10(11(8)14)13(19)18-5-3-17(2)4-6-18/h7H,3-6H2,1-2H3/p+1