(3-bromanyl-4-fluoranyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Traditional Name: (3-bromo-4-fluoro-benzyl)-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium Formula: C14H21BrFN2+ MolecularWeight: 316.232343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1C[NH2+]CC2=CC(=C(C=C2)F)Br

Isomeric SMILES

CCN1CCC[C@H]1C[NH2+]CC2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C14H20BrFN2/c1-2-18-7-3-4-12(18)10-17-9-11-5-6-14(16)13(15)8-11/h5-6,8,12,17H,2-4,7,9-10H2,1H3/p+1/t12-/m0/s1