(2S,3R)-2-azanyl-1-[(3S)-3-fluoranylpyrrolidin-1-yl]-3-oxidanyl-3-pyridin-4-yl-propan-1-one dihydrochloride

Systemtic Name: (2S,3R)-2-azanyl-1-[(3S)-3-fluoranylpyrrolidin-1-yl]-3-oxidanyl-3-pyridin-4-yl-propan-1-one dihydrochloride Openeye Name: (2S,3R)-2-amino-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-hydroxy-3-(4-pyridyl)propan-1-one dihydrochloride CAS Name: (2S,3R)-2-amino-1-[(3S)-3-fluoro-1-pyrrolidinyl]-3-hydroxy-3-pyridin-4-yl-1-propanone dihydrochloride IUPAC Name: (2S,3R)-2-amino-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-hydroxy-3-pyridin-4-ylpropan-1-one dihydrochloride Traditional Name: (2S,3R)-2-amino-1-[(3S)-3-fluoropyrrolidino]-3-hydroxy-3-(4-pyridyl)propan-1-one dihydrochloride Formula: C12H18Cl2FN3O2 MolecularWeight: 326.194623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1F)C(=O)C(C(C2=CC=NC=C2)O)N.Cl.Cl

Isomeric SMILES

C1CN(C[C@H]1F)C(=O)[C@H]([C@@H](C2=CC=NC=C2)O)N.Cl.Cl

InChI

InChI=1S/C12H16FN3O2.2ClH/c13-9-3-6-16(7-9)12(18)10(14)11(17)8-1-4-15-5-2-8;;/h1-2,4-5,9-11,17H,3,6-7,14H2;2*1H/t9-,10-,11+;;/m0../s1