2-[4-[5-(2-azaniumylethyl)-2-fluoranyl-phenyl]phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-[5-(2-azaniumylethyl)-2-fluoranyl-phenyl]phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[4-[5-(2-azaniumylethyl)-2-fluoro-phenyl]phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[4-[5-(2-ammonioethyl)-2-fluorophenyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[4-[5-(2-azaniumylethyl)-2-fluorophenyl]phenoxy]ethyl-dimethylazanium Traditional Name: 2-[4-[5-(2-ammonioethyl)-2-fluoro-phenyl]phenoxy]ethyl-dimethyl-ammonium Formula: C18H25FN2O+2 MolecularWeight: 304.402303

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=C(C=C1)C2=C(C=CC(=C2)CC[NH3+])F

Isomeric SMILES

C[NH+](C)CCOC1=CC=C(C=C1)C2=C(C=CC(=C2)CC[NH3+])F

InChI

InChI=1S/C18H23FN2O/c1-21(2)11-12-22-16-6-4-15(5-7-16)17-13-14(9-10-20)3-8-18(17)19/h3-8,13H,9-12,20H2,1-2H3/p+2