N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxy-propanamide

Systemtic Name: N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxy-propanamide Openeye Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxy-propanamide CAS Name: N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxypropanamide IUPAC Name: N-[2-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxypropanamide Traditional Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-2-methyl-2-phenoxy-propionamide Formula: C22H18BrN3O3 MolecularWeight: 452.30062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CC(=CN=C3)Br)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CC(=CN=C3)Br)OC4=CC=CC=C4

InChI

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