[5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-butyl-methyl-azanium

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-butyl-methyl-azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-butyl-methyl-ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-butyl-methylammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-butyl-methylazanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-butyl-methyl-ammonium Formula: C13H23FN2+2 MolecularWeight: 226.333523

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC(=C1)C[NH3+])F

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC(=C1)C[NH3+])F

InChI

InChI=1S/C13H21FN2/c1-3-4-7-16(2)10-12-8-11(9-15)5-6-13(12)14/h5-6,8H,3-4,7,9-10,15H2,1-2H3/p+2