(5-bromanyl-2-fluoranyl-phenyl)methyl-[(2R)-2-(dimethylamino)-3-ethyl-pentyl]azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-[(2R)-2-(dimethylamino)-3-ethyl-pentyl]azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-[(2R)-2-(dimethylamino)-3-ethyl-pentyl]ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-[(2R)-2-(dimethylamino)-3-ethylpentyl]ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-[(2R)-2-(dimethylamino)-3-ethylpentyl]azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-[(2R)-2-(dimethylamino)-3-ethyl-pentyl]ammonium Formula: C16H27BrFN2+ MolecularWeight: 346.301383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(CC)[C@H](C[NH2+]CC1=C(C=CC(=C1)Br)F)N(C)C

InChI

InChI=1S/C16H26BrFN2/c1-5-12(6-2)16(20(3)4)11-19-10-13-9-14(17)7-8-15(13)18/h7-9,12,16,19H,5-6,10-11H2,1-4H3/p+1/t16-/m0/s1