4-fluoranyl-3-[(1S,2R)-3-(methylamino)-2-oxidanyl-1-phenyl-propyl]-1-propan-2-yl-benzimidazol-2-one hydrochloride

Systemtic Name: 4-fluoranyl-3-[(1S,2R)-3-(methylamino)-2-oxidanyl-1-phenyl-propyl]-1-propan-2-yl-benzimidazol-2-one hydrochloride Openeye Name: 4-fluoro-3-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenyl-propyl]-1-isopropyl-benzimidazol-2-one hydrochloride CAS Name: 4-fluoro-3-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenylpropyl]-1-propan-2-yl-2-benzimidazolone hydrochloride IUPAC Name: 4-fluoro-3-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenylpropyl]-1-propan-2-ylbenzimidazol-2-one hydrochloride Traditional Name: 4-fluoro-3-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenyl-propyl]-1-isopropyl-benzimidazol-2-one hydrochloride Formula: C20H25ClFN3O2 MolecularWeight: 393.882803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=CC=C2)F)N(C1=O)C(C3=CC=CC=C3)C(CNC)O.Cl

Isomeric SMILES

CC(C)N1C2=C(C(=CC=C2)F)N(C1=O)[C@@H](C3=CC=CC=C3)[C@@H](CNC)O.Cl

InChI

InChI=1S/C20H24FN3O2.ClH/c1-13(2)23-16-11-7-10-15(21)19(16)24(20(23)26)18(17(25)12-22-3)14-8-5-4-6-9-14;/h4-11,13,17-18,22,25H,12H2,1-3H3;1H/t17-,18+;/m1./s1