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

Systemtic Name: [4,5-bis(fluoranyl)-2-methyl-phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (4,5-difluoro-2-methyl-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (4,5-difluoro-2-methylphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4,5-difluoro-2-methylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (4,5-difluoro-2-methyl-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C13H17F2N2O+ MolecularWeight: 255.283686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N2CC[NH+](CC2)C)F)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N2CC[NH+](CC2)C)F)F

InChI

InChI=1S/C13H16F2N2O/c1-9-7-11(14)12(15)8-10(9)13(18)17-5-3-16(2)4-6-17/h7-8H,3-6H2,1-2H3/p+1