2-(2-bromanyl-4-fluoranyl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4-fluoranyl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Openeye Name: 2-(2-bromo-4-fluoro-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone CAS Name: 2-(2-bromo-4-fluorophenoxy)-1-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone IUPAC Name: 2-(2-bromo-4-fluorophenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Formula: C19H22BrFN2O2 MolecularWeight: 409.292583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)COC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)COC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C19H22BrFN2O2/c1-22-10-5-7-16(22)17-6-3-2-4-11-23(17)19(24)13-25-18-9-8-14(21)12-15(18)20/h5,7-10,12,17H,2-4,6,11,13H2,1H3