2-bromanyl-1-(3,5-dimethylphenyl)-2-(2-phenylmethoxypyridin-4-yl)ethanone

Systemtic Name: 2-bromanyl-1-(3,5-dimethylphenyl)-2-(2-phenylmethoxypyridin-4-yl)ethanone Openeye Name: 2-(2-benzyloxy-4-pyridyl)-2-bromo-1-(3,5-dimethylphenyl)ethanone CAS Name: 2-bromo-1-(3,5-dimethylphenyl)-2-(2-phenylmethoxy-4-pyridinyl)ethanone IUPAC Name: 2-bromo-1-(3,5-dimethylphenyl)-2-(2-phenylmethoxypyridin-4-yl)ethanone Traditional Name: 2-(2-benzoxy-4-pyridyl)-2-bromo-1-(3,5-dimethylphenyl)ethanone Formula: C22H20BrNO2 MolecularWeight: 410.3037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C(C2=CC(=NC=C2)OCC3=CC=CC=C3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C(C2=CC(=NC=C2)OCC3=CC=CC=C3)Br)C

InChI

InChI=1S/C22H20BrNO2/c1-15-10-16(2)12-19(11-15)22(25)21(23)18-8-9-24-20(13-18)26-14-17-6-4-3-5-7-17/h3-13,21H,14H2,1-2H3