3-[3-[4-(3-bromanylpropyl)phenyl]-1-oxidanylidene-azetidin-1-ium-2-yl]-3-(4-fluorophenyl)propan-1-ol

Systemtic Name: 3-[3-[4-(3-bromanylpropyl)phenyl]-1-oxidanylidene-azetidin-1-ium-2-yl]-3-(4-fluorophenyl)propan-1-ol Openeye Name: 3-[3-[4-(3-bromopropyl)phenyl]-1-oxo-azetidin-1-ium-2-yl]-3-(4-fluorophenyl)propan-1-ol CAS Name: 3-[3-[4-(3-bromopropyl)phenyl]-1-oxo-2-azetidin-1-iumyl]-3-(4-fluorophenyl)-1-propanol IUPAC Name: 3-[3-[4-(3-bromopropyl)phenyl]-1-oxoazetidin-1-ium-2-yl]-3-(4-fluorophenyl)propan-1-ol Traditional Name: 3-[3-[4-(3-bromopropyl)phenyl]-1-keto-azetidin-1-ium-2-yl]-3-(4-fluorophenyl)propan-1-ol Formula: C21H24BrFNO2+ MolecularWeight: 421.323163

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C([N+]1=O)C(CCO)C2=CC=C(C=C2)F)C3=CC=C(C=C3)CCCBr

Isomeric SMILES

C1C(C([N+]1=O)C(CCO)C2=CC=C(C=C2)F)C3=CC=C(C=C3)CCCBr

InChI

InChI=1S/C21H24BrFNO2/c22-12-1-2-15-3-5-17(6-4-15)20-14-24(26)21(20)19(11-13-25)16-7-9-18(23)10-8-16/h3-10,19-21,25H,1-2,11-14H2/q+1