(3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(furan-2-ylmethyl)piperidin-1-ium

Systemtic Name: (3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(furan-2-ylmethyl)piperidin-1-ium Openeye Name: (3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(2-furylmethyl)piperidin-1-ium CAS Name: (3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(2-furanylmethyl)piperidin-1-ium IUPAC Name: (3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(furan-2-ylmethyl)piperidin-1-ium Traditional Name: (3S)-3-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-(2-furfuryl)piperidin-1-ium Formula: C19H21FN3O+ MolecularWeight: 326.387943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CO2)C3=C(C=NN3)C4=CC(=CC=C4)F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CO2)C3=C(C=NN3)C4=CC(=CC=C4)F

InChI

InChI=1S/C19H20FN3O/c20-16-6-1-4-14(10-16)18-11-21-22-19(18)15-5-2-8-23(12-15)13-17-7-3-9-24-17/h1,3-4,6-7,9-11,15H,2,5,8,12-13H2,(H,21,22)/p+1/t15-/m0/s1