[(1S)-2-azaniumyl-1-[3-[(4-fluorophenyl)methoxy]phenyl]ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-[3-[(4-fluorophenyl)methoxy]phenyl]ethyl]-diethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-[3-[(4-fluorophenyl)methoxy]phenyl]ethyl]-diethyl-ammonium CAS Name: [(1S)-2-ammonio-1-[3-[(4-fluorophenyl)methoxy]phenyl]ethyl]-diethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-[3-[(4-fluorophenyl)methoxy]phenyl]ethyl]-diethylazanium Traditional Name: [(1S)-2-ammonio-1-[3-(4-fluorobenzyl)oxyphenyl]ethyl]-diethyl-ammonium Formula: C19H27FN2O+2 MolecularWeight: 318.428883

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH3+])C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

Isomeric SMILES

CC[NH+](CC)[C@H](C[NH3+])C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H25FN2O/c1-3-22(4-2)19(13-21)16-6-5-7-18(12-16)23-14-15-8-10-17(20)11-9-15/h5-12,19H,3-4,13-14,21H2,1-2H3/p+2/t19-/m1/s1