1-[1-(5-bromanylpyridin-2-yl)piperazin-2-yl]-2-phenylmethoxy-ethanone

Systemtic Name: 1-[1-(5-bromanylpyridin-2-yl)piperazin-2-yl]-2-phenylmethoxy-ethanone Openeye Name: 2-benzyloxy-1-[1-(5-bromo-2-pyridyl)piperazin-2-yl]ethanone CAS Name: 1-[1-(5-bromo-2-pyridinyl)-2-piperazinyl]-2-phenylmethoxyethanone IUPAC Name: 1-[1-(5-bromopyridin-2-yl)piperazin-2-yl]-2-phenylmethoxyethanone Traditional Name: 2-benzoxy-1-[1-(5-bromo-2-pyridyl)piperazin-2-yl]ethanone Formula: C18H20BrN3O2 MolecularWeight: 390.2743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)COCC2=CC=CC=C2)C3=NC=C(C=C3)Br

Isomeric SMILES

C1CN(C(CN1)C(=O)COCC2=CC=CC=C2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C18H20BrN3O2/c19-15-6-7-18(21-10-15)22-9-8-20-11-16(22)17(23)13-24-12-14-4-2-1-3-5-14/h1-7,10,16,20H,8-9,11-13H2