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

Systemtic Name: 1-(2-fluorophenyl)-4-[(3S)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(2-fluorophenyl)-4-[(3S)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]piperazine CAS Name: 1-(2-fluorophenyl)-4-[(3S)-1-(1H-pyrazol-5-ylmethyl)-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(2-fluorophenyl)-4-[(3S)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(2-fluorophenyl)-4-[(3S)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]piperazine Formula: C19H27FN5+ MolecularWeight: 344.449583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=NN2)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=NN2)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C19H26FN5/c20-18-5-1-2-6-19(18)25-12-10-24(11-13-25)17-4-3-9-23(15-17)14-16-7-8-21-22-16/h1-2,5-8,17H,3-4,9-15H2,(H,21,22)/p+1/t17-/m0/s1