(3-bromanyl-4-fluoranyl-phenyl)methyl-[3-(2-methylpropoxy)propyl]azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-[3-(2-methylpropoxy)propyl]azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-(3-isobutoxypropyl)ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-[3-(2-methylpropoxy)propyl]ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-[3-(2-methylpropoxy)propyl]azanium Traditional Name: (3-bromo-4-fluoro-benzyl)-(3-isobutoxypropyl)ammonium Formula: C14H22BrFNO+ MolecularWeight: 319.232983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21BrFNO/c1-11(2)10-18-7-3-6-17-9-12-4-5-14(16)13(15)8-12/h4-5,8,11,17H,3,6-7,9-10H2,1-2H3/p+1