2-[3-[3-(3-fluoranylpyridin-4-yl)phenyl]pyrazol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[3-(3-fluoranylpyridin-4-yl)phenyl]pyrazol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-[3-(3-fluoro-4-pyridyl)phenyl]pyrazol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[3-[3-(3-fluoro-4-pyridinyl)phenyl]-1-pyrazolyl]ethyl-dimethylammonium IUPAC Name: 2-[3-[3-(3-fluoropyridin-4-yl)phenyl]pyrazol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-[3-(3-fluoro-4-pyridyl)phenyl]pyrazol-1-yl]ethyl-dimethyl-ammonium Formula: C18H20FN4+ MolecularWeight: 311.376603

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C=CC(=N1)C2=CC=CC(=C2)C3=C(C=NC=C3)F

Isomeric SMILES

C[NH+](C)CCN1C=CC(=N1)C2=CC=CC(=C2)C3=C(C=NC=C3)F

InChI

InChI=1S/C18H19FN4/c1-22(2)10-11-23-9-7-18(21-23)15-5-3-4-14(12-15)16-6-8-20-13-17(16)19/h3-9,12-13H,10-11H2,1-2H3/p+1