(3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidin-1-ium-1-yl-piperidine

Systemtic Name: (3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidin-1-ium-1-yl-piperidine Openeye Name: (3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidin-1-ium-1-yl-piperidine CAS Name: (3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-(1-pyrrolidin-1-iumyl)piperidine IUPAC Name: (3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidin-1-ium-1-ylpiperidine Traditional Name: (3S)-1-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidin-1-ium-1-yl-piperidine Formula: C19H26FN4+ MolecularWeight: 329.434943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CCCN(C2)CC3=C(NN=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C1CC[NH+](C1)[C@H]2CCCN(C2)CC3=C(NN=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C19H25FN4/c20-17-6-3-5-15(11-17)19-16(12-21-22-19)13-23-8-4-7-18(14-23)24-9-1-2-10-24/h3,5-6,11-12,18H,1-2,4,7-10,13-14H2,(H,21,22)/p+1/t18-/m0/s1