(3-bromanyl-4-fluoranyl-phenyl)methyl-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-[2-methyl-2-(4-methyl-1-piperazinyl)propyl]ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]azanium Traditional Name: (3-bromo-4-fluoro-benzyl)-[2-methyl-2-(4-methylpiperazino)propyl]ammonium Formula: C16H26BrFN3+ MolecularWeight: 359.300143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC(=C(C=C1)F)Br)N2CCN(CC2)C

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC(=C(C=C1)F)Br)N2CCN(CC2)C

InChI

InChI=1S/C16H25BrFN3/c1-16(2,21-8-6-20(3)7-9-21)12-19-11-13-4-5-15(18)14(17)10-13/h4-5,10,19H,6-9,11-12H2,1-3H3/p+1