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

Systemtic Name: (3S)-1-cyclobutyl-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-ium Openeye Name: (3S)-1-cyclobutyl-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-ium CAS Name: (3S)-1-cyclobutyl-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-ium IUPAC Name: (3S)-1-cyclobutyl-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-ium Traditional Name: (3S)-1-cyclobutyl-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-ium Formula: C18H23FN3+ MolecularWeight: 300.393723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[NH+]2CCCC(C2)C3=C(C=NN3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCC2)C3=C(C=NN3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H22FN3/c19-15-8-6-13(7-9-15)17-11-20-21-18(17)14-3-2-10-22(12-14)16-4-1-5-16/h6-9,11,14,16H,1-5,10,12H2,(H,20,21)/p+1/t14-/m0/s1