1-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-(2-chloranyl-4-fluoranyl-phenoxy)ethanone

Systemtic Name: 1-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-(2-chloranyl-4-fluoranyl-phenoxy)ethanone Openeye Name: 1-[(3S)-3-(1H-benzimidazol-2-yl)-1-piperidyl]-2-(2-chloro-4-fluoro-phenoxy)ethanone CAS Name: 1-[(3S)-3-(1H-benzimidazol-2-yl)-1-piperidinyl]-2-(2-chloro-4-fluorophenoxy)ethanone IUPAC Name: 1-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-(2-chloro-4-fluorophenoxy)ethanone Traditional Name: 1-[(3S)-3-(1H-benzimidazol-2-yl)piperidino]-2-(2-chloro-4-fluoro-phenoxy)ethanone Formula: C20H19ClFN3O2 MolecularWeight: 387.835163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC2=C(C=C(C=C2)F)Cl)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)COC2=C(C=C(C=C2)F)Cl)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H19ClFN3O2/c21-15-10-14(22)7-8-18(15)27-12-19(26)25-9-3-4-13(11-25)20-23-16-5-1-2-6-17(16)24-20/h1-2,5-8,10,13H,3-4,9,11-12H2,(H,23,24)/t13-/m0/s1