3-[1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-(4-bromo-2-fluorophenoxy)acetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C20H19BrFN3O3 MolecularWeight: 448.285563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)COC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)COC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H19BrFN3O3/c21-13-5-6-18(15(22)11-13)28-12-19(26)24-9-7-14(8-10-24)25-17-4-2-1-3-16(17)23-20(25)27/h1-6,11,14H,7-10,12H2,(H,23,27)