5-[(3S,4R)-4-(4-fluorophenyl)pyrrolidin-3-yl]-1H-pyrazole dihydrochloride

Systemtic Name: 5-[(3S,4R)-4-(4-fluorophenyl)pyrrolidin-3-yl]-1H-pyrazole dihydrochloride Openeye Name: 5-[(3S,4R)-4-(4-fluorophenyl)pyrrolidin-3-yl]-1H-pyrazole dihydrochloride CAS Name: 5-[(3S,4R)-4-(4-fluorophenyl)-3-pyrrolidinyl]-1H-pyrazole dihydrochloride IUPAC Name: 5-[(3S,4R)-4-(4-fluorophenyl)pyrrolidin-3-yl]-1H-pyrazole dihydrochloride Traditional Name: 5-[(3S,4R)-4-(4-fluorophenyl)pyrrolidin-3-yl]-1H-pyrazole dihydrochloride Formula: C13H16Cl2FN3 MolecularWeight: 304.190643

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)C2=CC=NN2)C3=CC=C(C=C3)F.Cl.Cl

Isomeric SMILES

C1[C@H]([C@@H](CN1)C2=CC=NN2)C3=CC=C(C=C3)F.Cl.Cl

InChI

InChI=1S/C13H14FN3.2ClH/c14-10-3-1-9(2-4-10)11-7-15-8-12(11)13-5-6-16-17-13;;/h1-6,11-12,15H,7-8H2,(H,16,17);2*1H/t11-,12+;;/m0../s1