2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)ethanamide Openeye Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]acetamide CAS Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)acetamide IUPAC Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)acetamide Traditional Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]acetamide Formula: C22H18BrN3O3 MolecularWeight: 452.30062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)C

InChI

InChI=1S/C22H18BrN3O3/c1-13-9-14(2)21(17(23)10-13)28-12-20(27)25-16-3-4-19-18(11-16)26-22(29-19)15-5-7-24-8-6-15/h3-11H,12H2,1-2H3,(H,25,27)