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

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone CAS Name: 2-(4-bromo-2-chlorophenoxy)-1-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Formula: C19H22BrClN2O2 MolecularWeight: 425.74718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrClN2O2/c1-22-10-5-7-16(22)17-6-3-2-4-11-23(17)19(24)13-25-18-9-8-14(20)12-15(18)21/h5,7-10,12,17H,2-4,6,11,13H2,1H3