2-(5-fluoranyl-2-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-3-yl)ethanenitrile hydrobromide

Systemtic Name: 2-(5-fluoranyl-2-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-3-yl)ethanenitrile hydrobromide Openeye Name: 2-(5-fluoro-2-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-3-yl)acetonitrile hydrobromide CAS Name: 2-(5-fluoro-2-methyl-7-phenacyl-3-pyrrolo[2,3-b]pyridinyl)acetonitrile hydrobromide IUPAC Name: 2-(5-fluoro-2-methyl-7-phenacylpyrrolo[2,3-b]pyridin-3-yl)acetonitrile hydrobromide Traditional Name: 2-(5-fluoro-2-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-3-yl)acetonitrile hydrobromide Formula: C18H15BrFN3O MolecularWeight: 388.233603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CN(C2=N1)CC(=O)C3=CC=CC=C3)F)CC#N.Br

Isomeric SMILES

CC1=C(C2=CC(=CN(C2=N1)CC(=O)C3=CC=CC=C3)F)CC#N.Br

InChI

InChI=1S/C18H14FN3O.BrH/c1-12-15(7-8-20)16-9-14(19)10-22(18(16)21-12)11-17(23)13-5-3-2-4-6-13;/h2-6,9-10H,7,11H2,1H3;1H