[(1S)-2-azaniumyl-1-[4-(4-fluoranylphenoxy)phenyl]ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-[4-(4-fluoranylphenoxy)phenyl]ethyl]-diethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-[4-(4-fluorophenoxy)phenyl]ethyl]-diethyl-ammonium CAS Name: [(1S)-2-ammonio-1-[4-(4-fluorophenoxy)phenyl]ethyl]-diethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-[4-(4-fluorophenoxy)phenyl]ethyl]-diethylazanium Traditional Name: [(1S)-2-ammonio-1-[4-(4-fluorophenoxy)phenyl]ethyl]-diethyl-ammonium Formula: C18H25FN2O+2 MolecularWeight: 304.402303

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH3+])C1=CC=C(C=C1)OC2=CC=C(C=C2)F

Isomeric SMILES

CC[NH+](CC)[C@H](C[NH3+])C1=CC=C(C=C1)OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN2O/c1-3-21(4-2)18(13-20)14-5-9-16(10-6-14)22-17-11-7-15(19)8-12-17/h5-12,18H,3-4,13,20H2,1-2H3/p+2/t18-/m1/s1