N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-3-chloranyl-4-ethoxy-benzamide

Systemtic Name: N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-3-chloranyl-4-ethoxy-benzamide Openeye Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-3-chloro-4-ethoxy-benzamide CAS Name: N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-3-chloro-4-ethoxybenzamide IUPAC Name: N-[2-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-yl]-3-chloro-4-ethoxybenzamide Traditional Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-3-chloro-4-ethoxy-benzamide Formula: C21H15BrClN3O3 MolecularWeight: 472.7191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

InChI

InChI=1S/C21H15BrClN3O3/c1-2-28-18-5-3-12(8-16(18)23)20(27)25-15-4-6-19-17(9-15)26-21(29-19)13-7-14(22)11-24-10-13/h3-11H,2H2,1H3,(H,25,27)