(3S)-3-(4-bromanyl-2-fluoranyl-phenoxy)pyrrolidin-1-ium

Systemtic Name: (3S)-3-(4-bromanyl-2-fluoranyl-phenoxy)pyrrolidin-1-ium Openeye Name: (3S)-3-(4-bromo-2-fluoro-phenoxy)pyrrolidin-1-ium CAS Name: (3S)-3-(4-bromo-2-fluorophenoxy)pyrrolidin-1-ium IUPAC Name: (3S)-3-(4-bromo-2-fluorophenoxy)pyrrolidin-1-ium Traditional Name: (3S)-3-(4-bromo-2-fluoro-phenoxy)pyrrolidin-1-ium Formula: C10H12BrFNO+ MolecularWeight: 261.110783

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC1OC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1C[NH2+]C[C@H]1OC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C10H11BrFNO/c11-7-1-2-10(9(12)5-7)14-8-3-4-13-6-8/h1-2,5,8,13H,3-4,6H2/p+1/t8-/m0/s1