(3S)-N-(4-bromanyl-2-fluoranyl-phenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-N-(4-bromanyl-2-fluoranyl-phenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-1-benzyl-N-(4-bromo-2-fluoro-phenyl)pyrrolidin-1-ium-3-amine CAS Name: (3S)-N-(4-bromo-2-fluorophenyl)-1-(phenylmethyl)-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-1-benzyl-N-(4-bromo-2-fluorophenyl)pyrrolidin-1-ium-3-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-(4-bromo-2-fluoro-phenyl)amine Formula: C17H19BrFN2+ MolecularWeight: 350.248563

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC2=C(C=C(C=C2)Br)F)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC2=C(C=C(C=C2)Br)F)CC3=CC=CC=C3

InChI

InChI=1S/C17H18BrFN2/c18-14-6-7-17(16(19)10-14)20-15-8-9-21(12-15)11-13-4-2-1-3-5-13/h1-7,10,15,20H,8-9,11-12H2/p+1/t15-/m0/s1